[ CAS No. 594-37-6 ] {[proInfo.proName]}

Name: 594-37-6|1,2-Dichloroisobutane|98%
Brand: Ambeed
SKU: A536123
Rating: 97 (27 reviews)

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Cat. No.: {[proInfo.prAm]}

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Quality Control of [ 594-37-6 ]

COA NMR CNMR HPLC LC-MS

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SDS Specification

Alternatived Products of [ 594-37-6 ]

Product Details of [ 594-37-6 ]

CAS No. :	594-37-6	MDL No. :	MFCD00000817
Formula :	C₄H₈Cl₂	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	OQPNDCHKFIHPBY-UHFFFAOYSA-N
M.W :	127.01	Pubchem ID :	117943
Synonyms :

Safety of [ 594-37-6 ]

Signal Word:	Danger	Class:	3
Precautionary Statements:	P210-P233-P240-P241-P242-P243-P280-P264-P261-P271-P303+P361+P353-P370+P378-P302+P352-P321-P332+P313-P362+P364-P305+P351+P338-P337+P313-P304+P340-P312-P403+P235-P403+P233-P405-P501	UN#:	1993
Hazard Statements:	H225-H315-H319-H335	Packing Group:	Ⅱ
GHS Pictogram:

Application In Synthesis of [ 594-37-6 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Downstream synthetic route of [ 594-37-6 ]

[ 594-37-6 ] Synthesis Path-Downstream 1~78

1
[ 594-37-6 ]
[ 74-85-1 ]
1,4-dichloro-2,2-dimethyl-butane [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With aluminium trichloride

Reference： [1]Schmerling; West [Journal of the American Chemical Society, 1952, vol. 74, p. 2885,2887]

2
[ 594-37-6 ]
[ 507-20-0 ]
[ 29559-52-2 ]

Reference： [1]Rogers; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1030]

3
[ 594-37-6 ]
[ 75-01-4 ]
1,1,4-trichloro-3,3-dimethyl-butane [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With aluminium trichloride

Reference： [1]Schmerling; West [Journal of the American Chemical Society, 1952, vol. 74, p. 2885,2887]

4
[ 594-37-6 ]
[ 56-23-5 ]
[ 67-72-1 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine at 400℃;

Reference： [1]McBee; Hass; Bordenca [Industrial and Engineering Chemistry, 1943, vol. 35, p. 318]

5
[ 594-37-6 ]
[ 558-43-0 ]

Reference： [1]Zhurnal Obshchei Khimii,1937,vol. 7,p. 1319
Chemisches Zentralblatt,1938,vol. 109,p. 561

6
[ 594-37-6 ]
[ 558-42-9 ]

Reference： [1]Journal of the American Chemical Society,1936,vol. 58,p. 1011
[2]Journal of the American Chemical Society,1936,vol. 58,p. 1011
[3]Journal of the Chemical Society,1956,p. 3337,3342,3344

7
[ 594-37-6 ]
[ 616-19-3 ]

Yield	Reaction Conditions	Operation in experiment
	With tetrachloromethane; chlorine; isobutene

Reference： [1]Ssorokin; Belikowa [vol. 1, # 3, p. 28][Chemisches Zentralblatt, 1928, vol. 99, # II, p. 801]

8
[ 594-37-6 ]
[ 29559-52-2 ]
[ 1871-58-5 ]

Reference： [1]Rogers; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1030]

9
[ 594-37-6 ]
[ 1871-58-5 ]

Yield	Reaction Conditions	Operation in experiment
	beim Chlorieren;

Reference： [1]Hatch; Russ; Gordon [Journal of the American Chemical Society, 1947, vol. 69, p. 2615] Rogers; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1030]

10
[ 594-37-6 ]
[ 513-37-1 ]

Yield	Reaction Conditions	Operation in experiment
	With potassium carbonate

Reference： [1]Mouneyrat [Annales de Chimie (Cachan, France), 1900, vol. <7>20, p. 522]

11
[ 594-37-6 ]
[ 18963-01-4 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine at 80 - 140℃; in der Damfphase;

Reference： [1]Chen et al. [Huaxue Xuebao/Acta Chimica Sinica, 1957, vol. 23, p. 124,127][Chem.Abstr., 1958, p. 14525]

12
[ 594-37-6 ]
[ 1985-96-2 ]

Yield	Reaction Conditions	Operation in experiment
	With aluminium trichloride; benzene

Reference： [1]Schmerling et al. [Journal of the American Chemical Society, 1956, vol. 78, p. 5406,5408]

13
[ 594-37-6 ]
[ 106-99-0 ]

Yield	Reaction Conditions	Operation in experiment
	at 600℃;

Reference： [1]Current Patent Assignee: I.G. FARBENINDUSTRIE AG (historic) - DE730519, 1938, C [DRP/DRBP Org.Chem.][DRP/DRBP Org.Chem.]

14
[ 594-37-6 ]
[ 78-84-2 ]

Yield	Reaction Conditions	Operation in experiment
	With water Hydrolysis;
	With water in Dampfform bei 350grad in Gegenwart verschiedener Katalysatoren;
	With aluminum oxide; water at 350℃;

Reference： [1]Hersh; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1631]
[2]Hersh; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1631]
[3]Hersh; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1631]

15
[ 75-28-5 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	at 40℃; durch Chlorierung;
	at 450 - 500℃; durch Chlorierung;

Reference： [1]Taft; Stratton [Industrial and Engineering Chemistry, 1948, vol. 40, p. 1488][Trans.Kansas Acad., 1945, vol. 48, p. 319][Chem.Abstr., 1946, p. 1736]
[2]Current Patent Assignee: PURDUE UNIVERSITY SYSTEM - US2004072, 1932, A Hass; McBee; Weber [Industrial and Engineering Chemistry, 1935, vol. 27, p. 1190/91]

16
[ 507-20-0 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine im diffusen Tageslicht;
	bei der photochemischen Chlorierung;
	With sulfuryl dichloride; chlorobenzene; dibenzoyl peroxide

	With antimonypentachloride
	With chlorine for 0.75h; Irradiation;
	With antimonypentachloride In dichloromethane for 0.166667h;
	Bei der photochemischen Chlorierung in fluessiger Phase;
88 %Spectr.	With Oxone; sodium chloride In chloroform; water at 20℃; for 4h; Sealed tube; Irradiation;
	With chlorine bei vermindertem Druck unter dem Einfluss ultravioletter Strahlen oder dunkler elektrischer Entladungen;

Reference： [1]d'Otreppe de Bouvette [Jahresbericht ueber die Fortschritte der Chemie und Verwandter Theile Anderer Wissenschaften, 1882, p. 441]
[2]Rogers; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1030]
[3]McBride; Beachell [Journal of the American Chemical Society, 1948, vol. 70, p. 2533]
[4]Meyer,V.; Mueller [Journal fur praktische Chemie (Leipzig 1954), 1892, vol. <2>46, p. 174]
[5]Field,K.W.; Kovacic,P. [Journal of Organic Chemistry, 1971, vol. 36, p. 3566 - 3571]
[6]Schneider, Hans-Joerg; Philippi, Klaus [Journal of Chemical Research, Miniprint, 1984, # 4, p. 901 - 951]
[7]Rogers; Nelson [Journal of the American Chemical Society, 1946, vol. 58, p. 1028]
[8]Zhao, Mengdi; Lu, Wenjun [Organic Letters, 2017, vol. 19, # 17, p. 4560 - 4563]
[9]Current Patent Assignee: BASF SE - DE259192, 1911, C [Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 11, p. 800][Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 11, p. 800]

17
[ 507-20-0 ]
[ 594-37-6 ]
[ 75-28-5 ]
[ 513-36-0 ]

Yield	Reaction Conditions	Operation in experiment
	Einwirkung von γ-Strahlen;

Reference： [1]Dismukes; Wilcox [Radiation Research, 1959, vol. 11, p. 754,756,757]

18
[ 78-84-2 ]
[ 598-76-5 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	With phosphorus pentachloride

Reference： [1]de la Mare; Salama [Journal of the Chemical Society, 1956, p. 3337,3342,3344]

19
[ 513-36-0 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	With antimonypentachloride

Reference： [1]Meyer,V.; Mueller [Journal fur praktische Chemie (Leipzig 1954), 1892, vol. <2>46, p. 174]

20
[ 513-36-0 ]
[ 594-37-6 ]
[ 75-28-5 ]
[ 507-20-0 ]

Yield	Reaction Conditions	Operation in experiment
	Einwirkung von γ-Strahlen;

Reference： [1]Dismukes; Wilcox [Radiation Research, 1959, vol. 11, p. 754,756,757]

21
[ 513-36-0 ]
[ 594-37-6 ]
[ 29559-52-2 ]

Yield	Reaction Conditions	Operation in experiment
	With aluminium trichloride; chlorine

Reference： [1]Miyagawa et al. [Bulletin of the Chemical Society of Japan, 1957, vol. 30, p. 218,220]

22
[ 115-11-7 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine
	With chlorine
	With chlorine In methanol

With chlorine

Reference： [1]Taft [Journal of the American Chemical Society, 1948, vol. 70, p. 3364 Anm.4] Burgin et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1418] Djakonow; Tischtschenko [Zhurnal Obshchei Khimii, vol. 9, p. 1261][Chemisches Zentralblatt, 1940, vol. 111, # I, p. 1971]
[2]Pogorshelski [Chemisches Zentralblatt, 1905, vol. 76, # I, p. 668] Ssorokin; Belikowa [vol. 1, # 3, p. 28][Chemisches Zentralblatt, 1928, vol. 99, # II, p. 801]
[3]Baluzow,W.M. et al. [Journal fur praktische Chemie (Leipzig 1954), 1975, vol. 317, p. 53 - 61]
[4]Negoro, Takeshi; Ikeda, Yoshitsugu [Bulletin of the Chemical Society of Japan, 1986, vol. 59, p. 2547 - 2552]

23
[ 115-11-7 ]
[ 513-37-1 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
	at 80℃; Chlorierung;
1: 6 % Chromat. 2: 77 % Chromat.	With chlorine In tetrachloromethane at 20℃;

Reference： [1]Striegler [1957, vol. 9, p. 523]
[2]Zelikman; Tyurin; Smirnov; Zyk [Russian Chemical Bulletin, 1998, vol. 47, # 8, p. 1541 - 1546]

24
[ 563-47-3 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
70%	With chloro-trimethyl-silane; water for 5h; Ambient temperature;
	With hydrogenchloride
	With hydrogenchloride at 60 - 65℃;

Reference： [1]Boudjouk, Philip; Kim, Beon-Kyu; Han, Byung-Hee [Synthetic Communications, 1996, vol. 26, # 18, p. 3479 - 3484]
[2]Schmerling; West [Journal of the American Chemical Society, 1952, vol. 74, p. 2885,2887]
[3]Burgin et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1418] Hatch; Russ; Gordon [Journal of the American Chemical Society, 1947, vol. 69, p. 2615]

25
[ 507-40-4 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	With diphenyl sulfide In benzene

Reference： [1]Walling,C.; Mintz,M.J. [Journal of Organic Chemistry, 1967, vol. 32, p. 1286 - 1289]

26
[ 115-11-7 ]
[ 594-37-6 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
	With nitrogen trichloride In dichloromethane
1: 79.47 %Chromat. 2: 8.73 %Chromat.	With chlorine at 70℃; for 24h; Inert atmosphere;	2 Example 2 Chlorine and nitrogen were mixed through a glass Y-tube at a flow rate of 30ml / min and 520ml / min,Mix with another glass Y-tube and isobutylene at a flow rate of 30ml / min.Then it entered a tubular reactor and reacted continuously at normal pressure and 70 ° C for 24 hours.The gas from the reactor directly enters the condensing tube for condensation, and the condensate enters the collector at the bottom, while the non-condensable gas from the top is absorbed by the water and lye in order and emptied.After the reaction is over,The composition of the collected condensate was analyzed by gas chromatography (the results are shown in Table 2); the chlorine content in water and lye was analyzed by chemical methods to investigate the total chlorine balance.

Reference： [1]Field,K.W.; Kovacic,P. [Journal of Organic Chemistry, 1971, vol. 36, p. 3566 - 3571]
[2]Current Patent Assignee: XIANGTAN UNIVERSITY - CN110642668, 2020, A Location in patent: Paragraph 0037; 0039

27
[ 594-37-6 ]
[ 201230-82-2 ]
[ 71-43-2 ]
[ 10489-28-8 ]

Yield	Reaction Conditions	Operation in experiment
	With aluminium trichloride at 24 - 27℃;

Reference： [1]Bruson,H.A.; Plant,H.L. [Journal of Organic Chemistry, 1967, vol. 32, p. 3356 - 3362]

28
[ 594-37-6 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
	at 380.1℃; pyrolysis; Ea; var. temp. and initial pressure;
99.6 %Chromat.	With sodium hydroxide In water Flow reactor; Reflux; Green chemistry; Industrial scale;

Reference： [1]Chucani, Gabriel; Rotinov, Alexandra; Martin, Ignacio; Avila, Irama; Dominguez, Rosa M. [Journal of Physical Chemistry, 1985, vol. 89, # 19, p. 4134 - 4137]
[2]Current Patent Assignee: ZHEJIANG UNIVERSITY; ZHEJIANG HUANGMA TECHNOLOGY CO LTD - US2021/363076, 2021, A1 Location in patent: Paragraph 0026

29
[ 115-11-7 ]
[ 107-07-3 ]
[ 594-37-6 ]
[ 1871-58-5 ]
[ 55982-53-1 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine In dichloromethane at -20℃; Yield given. Yields of byproduct given;

Reference： [1]Beger, J.; Schiefer, H.; Scheller, D. [Journal fur praktische Chemie (Leipzig 1954), 1983, vol. 325, # 5, p. 719 - 728]

30
[ 115-11-7 ]
[ 107-07-3 ]
[ 594-37-6 ]
[ 55982-53-1 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine In dichloromethane at -20℃; Yield given. Yields of byproduct given;

Reference： [1]Beger, J.; Schiefer, H.; Scheller, D. [Journal fur praktische Chemie (Leipzig 1954), 1983, vol. 325, # 5, p. 719 - 728]

31
[ 115-11-7 ]
[ 513-37-1 ]
[ 1871-57-4 ]
[ 594-37-6 ]
[ 35329-41-0 ]
[ 35329-40-9 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
	With chlorine at 40 - 70℃; various conc.; further products;

Reference： [1]Schulze, K.; Hartmann, S.; Krueger, H.; Muehlstaedt, M.; Richter, C.; Richter, H. [Journal fur praktische Chemie (Leipzig 1954), 1984, vol. 326, # 3, p. 433 - 442]

32
[ 115-11-7 ]
[ 513-37-1 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 1871-58-5 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
1: 9 % Chromat. 2: 69 % Chromat. 3: 19 % Chromat.	With Bu₃(PhCH₂)NCl*2Cl₂ In tetrachloromethane at 20℃; other reagents, other concentration;

Reference： [1]Zelikman; Tyurin; Smirnov; Zyk [Russian Chemical Bulletin, 1998, vol. 47, # 8, p. 1541 - 1546]

33
[ 115-11-7 ]
[ 594-37-6 ]
[ 1871-58-5 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
1: 8 % Chromat. 2: 18 % Chromat. 3: 74 % Chromat.	With Bu₃(PhCH₂)NCl*2Cl₂ In tetrachloromethane at 20℃;
1: 3 % Chromat. 2: 34 % Chromat. 3: 62 % Chromat.	With Bu₃(PhCH₂)NCl*2Cl₂ In tetrachloromethane at 20℃;

Reference： [1]Zelikman; Tyurin; Smirnov; Zyk [Russian Chemical Bulletin, 1998, vol. 47, # 8, p. 1541 - 1546]
[2]Zelikman; Tyurin; Smirnov; Zyk [Russian Chemical Bulletin, 1998, vol. 47, # 8, p. 1541 - 1546]

35
[ 7647-01-0 ]
[ 563-47-3 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	at 63℃;
	at 100℃;

Reference： [1]Burgin et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1418]
[2]Scheschukow [Zhurnal Russkago Fiziko-Khimicheskago Obshchestva, 1884, vol. 16, p. 495]

36
[ 7782-50-5 ]
[ 75-65-0 ]
[ 594-37-6 ]
[ 507-20-0 ]

Yield	Reaction Conditions	Operation in experiment
	im Sonnenlicht;

Reference： [1]D'Ottreppe de Bouvette [vol. <3>2, p. 490][Bull.de l'acad.royale des sci.,des lettres et des arts de Belgique, vol. <3>4, p. 359]

37
[ 56-23-5 ]
[ 7782-50-5 ]
[ 115-11-7 ]
[ 594-37-6 ]
[ 616-19-3 ]

Yield	Reaction Conditions	Operation in experiment
	at 15 - 16℃;

Reference： [1]Ssorokin; Belikowa [vol. 1, # 3, p. 28][Chemisches Zentralblatt, 1926, vol. 97, # II, p. 801]

38
[ 7446-70-0 ]
[ 7782-50-5 ]
[ 513-36-0 ]
[ 594-37-6 ]
[ 29559-52-2 ]

Reference： [1]Miyagawa et al. [Bulletin of the Chemical Society of Japan, 1957, vol. 30, p. 218,220]

39
[ 115-11-7 ]
[ 513-37-1 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
	at 200 - 450℃; Chlorierung;

Reference： [1]Striegler [1957, vol. 9, p. 523]

40
[ 7782-50-5 ]
[ 115-11-7 ]
[ 3375-22-2 ]
[ 594-37-6 ]
[ 507-20-0 ]

Yield	Reaction Conditions	Operation in experiment
	Trichlorisobutan;

Reference： [1]Pogorzelski [Chemisches Zentralblatt, 1905, vol. 76, # I, p. 667]

41
[ 7782-50-5 ]
[ 115-11-7 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 1871-58-5 ]

Yield	Reaction Conditions	Operation in experiment
	at 18℃; und 30grad;
	at -60 - -40℃;
	at 0℃;

Reference： [1]Taft [Journal of the American Chemical Society, 1948, vol. 70, p. 3364 Anm.4]
[2]Burgin et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1418]
[3]Djakonow; Tischtschenko [Zhurnal Obshchei Khimii, 1939, vol. 9, p. 1261][Chemisches Zentralblatt, 1940, vol. 111, # I, p. 1971] Burgin et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1418]

42
[ 7782-50-5 ]
[ 115-11-7 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 1871-58-5 ]

Yield	Reaction Conditions	Operation in experiment
	at 550℃;

Reference： [1]Current Patent Assignee: I.G. FARBENINDUSTRIE AG (historic); GEORGE WILLIAM JOHNSON - DE720079, 1936, C [DRP/DRBP Org.Chem.][DRP/DRBP Org.Chem.]

43
[ 7732-18-5 ]
[ 7553-56-2 ]
[ 7782-50-5 ]
[ 115-11-7 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 1871-58-5 ]

Yield	Reaction Conditions	Operation in experiment
	at 70℃;

Reference： [1]Groll et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1242]

44
[ 7732-18-5 ]
[ 7782-50-5 ]
[ 115-11-7 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 1871-58-5 ]

Yield	Reaction Conditions	Operation in experiment
	at 70℃;

Reference： [1]Groll et al. [Industrial and Engineering Chemistry, 1939, vol. 31, p. 1242]

45
[ 7446-70-0 ]
[ 594-37-6 ]
[ 82166-21-0 ]
[ 71-43-2 ]
[ 538-93-2 ]

Yield	Reaction Conditions	Operation in experiment
	at 4℃;

Reference： [1]Schmerling et al. [Journal of the American Chemical Society, 1956, vol. 78, p. 5406,5408]

Yield	Reaction Conditions	Operation in experiment
	Reaktivitaet gegenueber der Photochlorier. (Tab.1);
	Photochlorierung: Rel. Reaktivitaet, r.r.(-CH2Cl/-CH3);
	Rk. mit Benzol, Al(C2H5)3;

	Chlorierung von Isobutan in Methanol;
	Kat. Dehydrohalogenierung zu : CH2Cl-C(CH3)=CH2; Kp(125-197grad); ΔH; ΔS;
	Kat. Dehydrohalogenierung zu : CH3-C(CH3)=CHCl; Kp(125-197grad); ΔH; ΔS;
	Isomerisierungs-Gl.gew. m. 1,1-Dichlorisobutan bei 30-150grad; ΔH; ΔS;
	k(rel) der Chlorierung mit t-BuOCl;
	k(rel) der Chlorierung mit Cl2;

Yield	Reaction Conditions	Operation in experiment
	at 45℃; relative Geschwindigkeit der Solvolyse;

Yield	Reaction Conditions	Operation in experiment
	at 45℃; relative Geschwindigkeit der Solvolyse;
	at 79℃; Hydrolysis;

Yield	Reaction Conditions	Operation in experiment
	at 45℃; relative Geschwindigkeit der Solvolyse;

53
[ 7647-01-0 ]
[ 558-42-9 ]
[ 594-37-6 ]

Reference： [1]Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences,1906,vol. 142,p. 496
Chemisches Zentralblatt,1906,vol. 77,p. 1178

54
[ 507-20-0 ]
[ 7782-50-5 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	in Dampfform unter vermindertem Druck unter dem Einfluss ultravioletter Strahlen oder dunkler elektrischer Entladungen;

Reference： [1]Current Patent Assignee: BASF SE - DE259192, 1911, C [Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 11, p. 800][Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 11, p. 800]

55
[ 7791-25-5 ]
[ 507-20-0 ]
[ 108-90-7 ]
[ 94-36-0 ]
[ 594-37-6 ]

Reference： [1]McBride; Beachell [Journal of the American Chemical Society, 1948, vol. 70, p. 2533]

56
[ 594-37-6 ]
[ 7732-18-5 ]
[ 558-42-9 ]

Reference： [1]Journal of the American Chemical Society,1936,vol. 58,p. 1011

57
[ 7446-70-0 ]
[ 594-37-6 ]
[ 74-85-1 ]
1,4-dichloro-2,2-dimethyl-butane [ No CAS ]

Reference： [1]Schmerling; West [Journal of the American Chemical Society, 1952, vol. 74, p. 2885,2887]

58
[ 7446-70-0 ]
[ 594-37-6 ]
[ 75-01-4 ]
1,1,4-trichloro-3,3-dimethyl-butane [ No CAS ]

Reference： [1]Schmerling; West [Journal of the American Chemical Society, 1952, vol. 74, p. 2885,2887]

59
[ 594-37-6 ]
[ 7782-50-5 ]
[ 56-23-5 ]
[ 67-72-1 ]

Yield	Reaction Conditions	Operation in experiment
	at 400℃;

Reference： [1]McBee; Hass; Bordenca [Industrial and Engineering Chemistry, 1943, vol. 35, p. 318]

60
[ 594-37-6 ]
[ 4300-97-4 ]

Yield	Reaction Conditions	Operation in experiment
24%	With trifluorormethanesulfonic acid In tetrachloromethane at -25℃; for 1h;

Reference： [1]Brunet, J.-J.; Legars, P.; Peres, Y.; Tkatchenko, I.; Lecolier, S. [Tetrahedron Letters, 1988, vol. 29, # 36, p. 4569 - 4572]

61
[ 7446-70-0 ]
[ 594-37-6 ]
[ 71-43-2 ]
[ 538-93-2 ]
[ 1985-96-2 ]
[ 1245924-68-8 ]

Reference： [1]Schmerling et al. [Journal of the American Chemical Society, 1956, vol. 78, p. 5406,5408]

62
[ 594-37-6 ]
[ 78-84-2 ]

Yield	Reaction Conditions	Operation in experiment
	at 350℃; Hydrolysis;
	Hydrolysis;

Reference： [1]Hersh; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1631]
[2]Hersh; Nelson [Journal of the American Chemical Society, 1936, vol. 58, p. 1631]

63
[ 594-37-6 ]
natrium carbonate [ No CAS ]
[ 558-43-0 ]
[ 78-84-2 ]

Reference： [1]Zhurnal Obshchei Khimii,vol. 7,p. 1320
Chemisches Zentralblatt,1938,vol. 109,p. 561

64
[ 594-37-6 ]
sodium bicarbonate [ No CAS ]
[ 558-43-0 ]
[ 78-84-2 ]

Reference： [1]Zhurnal Obshchei Khimii,vol. 7,p. 1320
Chemisches Zentralblatt,1938,vol. 109,p. 561

65
[ 594-37-6 ]
[ 7732-18-5 ]
[ 513-37-1 ]
[ 558-42-9 ]
[ 563-47-3 ]

Reference： [1]Journal of the Chemical Society,1956,p. 3337,3342,3344

66
[ 594-37-6 ]
aqueous NaOH-solution [ No CAS ]
[ 513-37-1 ]
[ 558-42-9 ]
[ 563-47-3 ]

Reference： [1]Journal of the Chemical Society,1956,p. 3337,3342,3344

67
[ 513-36-0 ]
[ 594-37-6 ]

Yield	Reaction Conditions	Operation in experiment
	With aluminium trichloride; chlorine

Reference： [1]Mouneyrat [Annales de Chimie (Cachan, France), 1900, vol. <7>20, p. 522]

68
[ 594-37-6 ]
[ 120-80-9 ]
[ 107189-19-5 ]

Yield	Reaction Conditions	Operation in experiment
	With sulfuric acid; sodium carbonate In 2-ethoxy-ethanol; water	2 Preparation of 2-(2-hydroxy-2-methylpropoxy)phenol from 1,2-dichloro-2-methylpropane EXAMPLE 2 Preparation of 2-(2-hydroxy-2-methylpropoxy)phenol from 1,2-dichloro-2-methylpropane Catechol (22.0 g, 0.20 mole), sodium carbonate (23.3 g, 0.22 mole), 1,2-dichloro-2-methylpropane (48 g, 0.30 mole), and 160 ml 2-ethoxyethanol were combined in a 500 ml 3-necked round bottom flask equipped with an air stirrer, thermometer, nitrogen inlet, heating mantle and condenser. The flask was flushed with nitrogen, then heated at 85°-95° C. for 5 hours. The reaction was cooled, then acidified with 150 ml of 10% aqueous sulfuric acid. Water (250 ml) was added and the mixture was extracted three times with 150 ml diethyl ether. Concentration of the combined ether layers afforded 26.2 g orange solid, which was mostly catechol. The solid was partitioned between 200 ml water and 200 ml of dichloromethane. The dichloromethane layer was washed five times with 100 ml of water to remove residual catechol. Concentration of the dried dichloromethane layers afforded 6.4 g (18%) orange solid, which was recrystallized from toluene. This gave pale yellow crystals, m.p. 107°-108° C. 1 Hnmr analysis and mass spctral analysis were consistent with the structural formula of 2-(2-hydroxy-2-methylpropoxy)phenol.

Reference： [1]Current Patent Assignee: SANOFI - US4639536, 1987, A

69
[ 594-37-6 ]
[ 120-80-9 ]
[ 4790-71-0 ]
[ 107189-19-5 ]

Yield	Reaction Conditions	Operation in experiment
	With sodium hydroxide In 2-methoxy-ethanol; water	3 Preparation of 2-(2-hydroxy-2-methylpropoxy)phenol and 2-methallyloxyphenol from 1,2-dichloro-2-methylpropane EXAMPLE 3 Preparation of 2-(2-hydroxy-2-methylpropoxy)phenol and 2-methallyloxyphenol from 1,2-dichloro-2-methylpropane Catechol (11.0 g, 0.10 mole) and 80 ml of 2-methoxyethanol were combined in a 250 ml flask equipped with an air stirrer, thermometer, nitrogen inlet, heating mantle and condenser. Sodium hydroxide (4.0 g, 0.10 mole) was added gradually and then the mixture was refluxed for 0.5 hours (124° C.) 1,2-Dichloro-2-methylpropane (19.1 g, 0.15 mole) was added and the mixture was refluxed for 5 hours (124° C.). The mixture was cooled and left standing overnight. Water (150 ml), acidified with hydrochloric acid, was added and the mixture was extracted five times with 75 ml of dichloromethane. The combined dichloromethane layers were washed with water, dried over magnesium sulfate and filtered. Gas-liquid chromatography analysis showed that 75% of the catechol remained, 16% was converted to 2-methallyloxyphenol and 9% was converted to 2-(2-hydroxy-2-methylpropoxy)phenol.

Reference： [1]Current Patent Assignee: SANOFI - US4639536, 1987, A

70
[ 594-37-6 ]
[ 4300-97-4 ]

Yield	Reaction Conditions	Operation in experiment
	With 1,2,3-trichlorobenzene In CO	20 EXAMPLE 20 EXAMPLE 20 185 ml (268 g) of trichlorobenzene and 13.3 g (0.1 mol) of AlCl3 are initially introduced into a 0.7 l V4A stainless steel autoclave. 254.0 g (2.0 mols) of 1,2-dichloro-2-methylpropane are pumped in with stirring in the course of 20 minutes at 0°-3° C. and under 120 bar of CO. The CO pressure is maintained at a constant value by replenishing CO via a reducing valve. After 20 minutes no more CO is taken up. The autoclave pressure is let down, and the dark yellow reaction mixture is distilled via a 30 cm Vigreux column. 50.3 g of 1,2-dichloro-2-methylpropane and 208.6 g of chloropivaloyl chloride are obtained. This corresponds to a conversion of 80.2% and a selectivity of 83.9%.

Reference： [1]Current Patent Assignee: BAYER AG - US4863642, 1989, A

71
[ 594-37-6 ]
[ 6180-99-0 ]
[ 1461-22-9 ]

Yield	Reaction Conditions	Operation in experiment
	In not given byproducts: (CH3)2CDCH2Cl;

Reference： [1]Pommier, J. C.; Chevolleau, D. [Journal of Organometallic Chemistry, 1974, vol. 74, p. 405 - 416] [Gmelin Handbuch der Anorganischen Chemie, Gmelin Handbook: Sn: Org.Verb.4, 1.2.1.1.5.4.2, page 52 - 57]

72
[ 558-42-9 ]
[ 594-37-6 ]

Reference： [1]Organic and Biomolecular Chemistry,2008,vol. 6,p. 2790 - 2795

73
[ 594-37-6 ]
[ 1590-08-5 ]
[ 1255327-54-8 ]

Yield	Reaction Conditions	Operation in experiment
75%	Stage #1: 2-methyl-1-tetralone With lithium diisopropyl amide In tetrahydrofuran; hexane at -78℃; for 1h; Inert atmosphere; Stage #2: 1,2-dichloro-2-methylpropane In tetrahydrofuran; hexane at -78 - 20℃; Inert atmosphere;

Reference： [1]Location in patent: experimental part Poisson, Thomas; Gembus, Vincent; Dalla, Vincent; Oudeyer, Sylvain; Levacher, Vincent [Journal of Organic Chemistry, 2010, vol. 75, # 22, p. 7704 - 7716]

74
[ 594-37-6 ]
[ 115-11-7 ]

Yield	Reaction Conditions	Operation in experiment
	With 0.5C₄H₈OC₂₄H₂₀B^(1-)C₃₆H₆₄CoN₈⁽¹⁺⁾ In tetrahydrofuran at -116 - 20℃; for 24h; Inert atmosphere;

Reference： [1]Location in patent: experimental part Mo, Zhenbo; Li, Yuxue; Lee, Hung Kay; Deng, Liang [Organometallics, 2011, vol. 30, # 17, p. 4687 - 4694]

75
[ 92-61-5 ]
[ 594-37-6 ]
C₁₄H₁₅ClO₄ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
65%	With potassium carbonate; In acetonitrile; at 40℃; for 18h;	Take scopolamine 576 mg (3 mM),XRX3mM and an appropriate amount of anhydrous potassium carbonate,Dissolved in 9mL acetonitrile,The reaction was stirred at 20-50 C (reflux) for 6-24 h,The mixture was cooled to room temperature,filter,Filtrate decompression recovery,The residue was dissolved in 3 mL of ethyl acetate,Stirring the appropriate amount of K0H reaction 2h to remove unreacted raw materials,filter,The filtrate is recovered under reduced pressure to obtain the target mixed product,The mixture has two spots,

Reference： [1]Patent: CN103965150,2016,B .Location in patent: Paragraph 0058-0061; 0065

76
[ 507-20-0 ]
[ 594-37-6 ]
[ 1871-58-5 ]

Yield	Reaction Conditions	Operation in experiment
1: 65 %Spectr. 2: 12 %Spectr.	With Oxone; sodium chloride In chloroform; water at 20℃; for 4h; Sealed tube; Irradiation;

Reference： [1]Zhao, Mengdi; Lu, Wenjun [Organic Letters, 2017, vol. 19, # 17, p. 4560 - 4563]

77
[ 115-11-7 ]
[ 594-37-6 ]
[ 507-20-0 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
1: 54.41 %Chromat. 2: 20.17 %Chromat. 3: 10.43 %Chromat.	With chlorine at 70℃; for 24h;	2 Example 2 Chlorine and nitrogen were mixed through a glass Y-tube at a flow rate of 30ml / min and 520ml / min,Mix with another glass Y-tube and isobutylene at a flow rate of 30ml / min.Then it entered a tubular reactor and reacted continuously at normal pressure and 70 ° C for 24 hours.The gas from the reactor directly enters the condensing tube for condensation, and the condensate enters the collector at the bottom, while the non-condensable gas from the top is absorbed by the water and lye in order and emptied.After the reaction is over,The composition of the collected condensate was analyzed by gas chromatography (the results are shown in Table 2); the chlorine content in water and lye was analyzed by chemical methods to investigate the total chlorine balance.
	With nitrogen; chlorine at 55℃; for 24h; Sealed tube;	1 Example 1 Chlorine and nitrogen are first mixed through a Y-tube at a flow rate of 30 ml / min and 300 ml / min, and then mixed with isobutylene with a flow of 150 ml / min through another Y-tube, and then enter a cooling jacket Water temperature 55 ) atmospheric pressure tubular reactor, reaction residence time 3.54 s, continuous reaction for 24 hours. The gas from the reactor first enters a condenser for cooling and condensation, and its condensate enters the collector at the bottom, while the non-condensable gas from the top is absorbed by clear water and lye in turn and emptied. After the reaction, the composition of the collected condensate was analyzed by gas chromatography (the results are shown in Table 1), and the chlorine content in water and lye was analyzed by chemical method to investigate the total chlorine balance.

Reference： [1]Current Patent Assignee: XIANGTAN UNIVERSITY - CN110642668, 2020, A Location in patent: Paragraph 0037-0039
[2]Current Patent Assignee: XIANGTAN UNIVERSITY - CN110642667, 2020, A Location in patent: Paragraph 0022; 0026

78
[ 115-11-7 ]
[ 594-37-6 ]
[ 513-36-0 ]
[ 563-47-3 ]

Yield	Reaction Conditions	Operation in experiment
	With nitrogen; chlorine at 55℃; for 24h; Sealed tube;	Comparative example First mix 30ml / min of chlorine gas with 520 ml / min of nitrogen through a Y-tube, then mix with 30 ml / min of isobutylene through another Y-tube, and then enter a cooling jacket (cooling water temperature 55 ° C) The atmospheric pressure tubular reactor has a reaction residence time of 3.01 s and a continuous reaction for 24 hours. The gas from the reactor first enters a condenser for cooling and condensation, and its condensate enters the collector at the bottom, while the non-condensable gas from the top is absorbed by clear water and lye in turn and evacuated. After the reaction, the composition of the collected condensate was analyzed by gas chromatography. The results are shown in Table 1. At the same time, the chlorine content in water and lye was analyzed by chemical method to investigate the total chlorine balance.

Reference： [1]Current Patent Assignee: XIANGTAN UNIVERSITY - CN110642667, 2020, A Location in patent: Paragraph 0025; 0026

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P378
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H200	Unstable explosive
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H250	Catches fire spontaneously if exposed to air
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H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
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Health hazards
Code	Phrase
H300	Fatal if swallowed
H301	Toxic if swallowed
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H316	Causes mild skin irritation
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H372	Causes damage to organs through prolonged or repeated exposure
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Code	Phrase
H400	Very toxic to aquatic life
H401	Toxic to aquatic life
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H410	Very toxic to aquatic life with long-lasting effects
H411	Toxic to aquatic life with long-lasting effects
H412	Harmful to aquatic life with long-lasting effects
H413	May cause long-lasting harmful effects to aquatic life
H420	Harms public health and the environment by destroying ozone in the upper atmosphere

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