[ CAS No. 6259-19-4 ] {[proInfo.proName]}

Name: 6259-19-4|3,7-Diaminodibenzo[b,d]thiophene 5,5-dioxide|97%
Brand: Ambeed
SKU: A618874
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2D 3D

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Quality Control of [ 6259-19-4 ]

COA NMR CNMR HPLC LC-MS

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SDS Specification

Alternatived Products of [ 6259-19-4 ]

Product Details of [ 6259-19-4 ]

CAS No. :	6259-19-4	MDL No. :	MFCD00159114
Formula :	C₁₂H₁₀N₂O₂S	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	FUXZRRZSHWQAAA-UHFFFAOYSA-N
M.W :	246.29	Pubchem ID :	80412
Synonyms :

Calculated chemistry of [ 6259-19-4 ]

Physicochemical Properties

Num. heavy atoms :	17
Num. arom. heavy atoms :	12
Fraction Csp3 :	0.0
Num. rotatable bonds :	0
Num. H-bond acceptors :	2.0
Num. H-bond donors :	2.0
Molar Refractivity :	66.18
TPSA :	94.56 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	No
P-gp substrate :	Yes
CYP1A2 inhibitor :	Yes
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	Yes
Log Kp (skin permeation) :	-7.05 cm/s

Lipophilicity

Log Po/w (iLOGP) :	1.08
Log Po/w (XLOGP3) :	1.06
Log Po/w (WLOGP) :	2.76
Log Po/w (MLOGP) :	1.48
Log Po/w (SILICOS-IT) :	1.13
Consensus Log Po/w :	1.5

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	0.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-2.56
Solubility :	0.683 mg/ml ; 0.00277 mol/l
Class :	Soluble
Log S (Ali) :	-2.64
Solubility :	0.568 mg/ml ; 0.00231 mol/l
Class :	Soluble
Log S (SILICOS-IT) :	-4.12
Solubility :	0.0186 mg/ml ; 0.0000757 mol/l
Class :	Moderately soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	1.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	2.56

Safety of [ 6259-19-4 ]

Signal Word:	Warning	Class:	N/A
Precautionary Statements:	P280-P305+P351+P338	UN#:	N/A
Hazard Statements:	H317-H319	Packing Group:	N/A
GHS Pictogram:

Application In Synthesis of [ 6259-19-4 ]

* 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 [ 6259-19-4 ]

[ 6259-19-4 ] Synthesis Path-Downstream 1~26

1
[ 83834-12-2 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
	With ammonium hydroxide; copper(l) chloride at 250℃;

Reference： [1]Courtot; Chang [Bulletin de la Societe Chimique de France, 1931, vol. <4>, p. 1047,1062]

2
[ 6259-19-4 ]
[ 87-02-5 ]
[ 84045-86-3 ]

Yield	Reaction Conditions	Operation in experiment
	Diazotization;

Reference： [1]Krepelka; Rais [Collection of Czechoslovak Chemical Communications, 1950, vol. 15, p. 412,425, 426]

3
[ 6259-19-4 ]
[ 108-24-7 ]
[ 54635-78-8 ]

Yield	Reaction Conditions	Operation in experiment
65%	With triethylamine In tetrahydrofuran for 2h;
	With sodium acetate

Reference： [1]Lee, Sujin; Esteva-Font, Cristina; Phuan, Puay-Wah; Anderson, Marc O.; Verkman [MedChemComm, 2015, vol. 6, # 7, p. 1278 - 1284]
[2]Courtot; Evain [Bulletin de la Societe Chimique de France, 1931, vol. <4> 49, p. 527,528] Courtot; Chang [Bulletin de la Societe Chimique de France, 1931, vol. <4>, p. 1047,1062]

4
[ 6259-19-4 ]
[ 98-88-4 ]
[ 127330-65-8 ]

Yield	Reaction Conditions	Operation in experiment
	With potassium carbonate; toluene
		61 N,N'-(5,5-Dioxodibenzothiophene-3,7-diyl) bisbenzenamide EXAMPLE 61 N,N'-(5,5-Dioxodibenzothiophene-3,7-diyl) bisbenzenamide The procedure of Example 60 was followed using 3,7-diamino-dibenzothiophene S,S-dioxide and benzoyl chloride giving the desired product as a yellow solid.

Reference： [1]Courtot; Evain [Bulletin de la Societe Chimique de France, 1931, vol. <4> 49, p. 527,528] Courtot; Chang [Bulletin de la Societe Chimique de France, 1931, vol. <4>, p. 1047,1062]
[2]Current Patent Assignee: PFIZER INC - US4965284, 1990, A

5
[ 6259-19-4 ]
[ 148-75-4 ]
3,7-bis-(2-hydroxy-3,6-disulfo-[1]naphthylazo)-dibenzothiophene-5,5-dioxide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Diazotization;

Reference： [1]Allan; Muzik [Collection of Czechoslovak Chemical Communications, 1953, vol. 18, p. 663,665, 670][Chem.Abstr., 1955, p. 207]

6
[ 6259-19-4 ]
[ 121-60-8 ]
3,7-bis-sulfanilylamino-dibenzothiophene-5,5-dioxide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With pyridine; acetone Erhitzen des Reaktionsprodukts mit wss. Salzsaeure;

Reference： [1]Current Patent Assignee: I.G. FARBENINDUSTRIE AG (historic) - DE694946, 1937, C [DRP/DRBP Org.Chem.][DRP/DRBP Org.Chem.] Current Patent Assignee: WINTHROP CHEM - US2280497, 1938, A

7
[ 6259-19-4 ]
[ 121-60-8 ]
3,7-bis-[(<i>N</i>-acetyl-sulfanilyl)-amino]-dibenzothiophene-5,5-dioxide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With sodium hydrogencarbonate; acetone

Reference： [1]Kawai; Ueda [Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan, 1951, vol. 71, p. 1478,1480][Chem.Abstr., 1952, p. 8035]

8
[ 6259-19-4 ]
[ 1016-05-3 ]

Yield	Reaction Conditions	Operation in experiment
	With hydrogenchloride; ethanol; sodium nitrite

Reference： [1]Courtot; Evain [Bulletin de la Societe Chimique de France, 1931, vol. <4> 49, p. 1555,1556] Cullinane; Davies [Recueil des Travaux Chimiques des Pays-Bas, 1936, vol. 55, p. 881,884]

9
[ 6259-19-4 ]
[ 83834-12-2 ]

Yield	Reaction Conditions	Operation in experiment
	With hydrogenchloride; copper(I) bromide; sodium nitrite

Reference： [1]Courtot; Evain [Bulletin de la Societe Chimique de France, 1931, vol. <4> 49, p. 1555,1556] Cullinane et al. [Journal of the Chemical Society, 1936, p. 1435]

10
[ 6259-19-4 ]
3,7-diisocyanato-dibenzothiophene-5,5-dioxide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With phosgene

Reference： [1]Siefken [Justus Liebigs Annalen der Chemie, 1949, vol. 562, p. 75,1114]

11
[ 58920-49-3 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
81.6%	With hydrogenchloride; acetic acid; tin(ll) chloride at 70 - 80℃; for 0.166667h;
	With hydrogenchloride; acetic acid; tin(ll) chloride
	With water; iron(III) chloride; iron

In <i>N</i>-methyl-acetamide; (2S)-N-methyl-1-phenylpropan-2-amine hydrate; acetic acid

2 3,7-Diaminodibenzothiophene S,S-dioxide EXAMPLE 2 3,7-Diaminodibenzothiophene S,S-dioxide A mixture of 10.0 g of 3,7-dinitrodibenzothiophene S,S-dioxide, 180 ml of dimethylformamide, 20 ml of glacial acetic acid and 1.0 g of 5% palladium on carbon was hydrogenated in a Parr apparatus until hydrogen uptake ceased. The mixture was then filtered through diatomaceous earth, the filtrate poured into 1 liter of ice water, the solid collected by filtration, washed with ethanol and ether and dried at 110° C., giving 7.86 g of the desired product as a solid mp 320°-330° C.(dec.).

Reference： [1]Nelsen, Stephen F.; Luo, Yun; Weaver, Michael N.; Lockard, Jenny V.; Zink, Jeffrey I. [Journal of Organic Chemistry, 2006, vol. 71, # 11, p. 4286 - 4295]
[2]Brown et al. [Journal of the American Chemical Society, 1952, vol. 74, p. 1165]
[3]Cullinane et al. [Journal of the Chemical Society, 1936, p. 1435]
[4]Current Patent Assignee: PFIZER INC - US4965284, 1990, A

12
[ 92-87-5 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
68.3%	With sulfuric acid; sulfur trioxide at 120℃; for 3.5h;	Benzidine Sulfone (3,7-Diamino-5,5'-dioxodibenzothiophene) Eighty milliliters of 20% oleum were placed into athree-necked flask equipped with a mechanical stirrer, thermometer, and air condenser with a calcium chloride drying tube. Twenty grams of benzidine 1 were added in small portions under stirring so that the reaction mixture would not be heated above 60°C. This was followed by heating the mixture in an oil bath at 120°C for 3.5 h. The flask contents were cooled toroom temperature under stirring and poured in small portions into 250 g of ice. The resulting precipitate was filtered off, washed with water, transferred to a beaker, and a solution of 30% NaOH was added in small amounts with cooling and stirring to an alkaline pH of 11. The resulting benzidine sulfone 2 was filtered off, washed with water and 40 mL of ethanol, and dried at room temperature for one day. The product was reprecipitated from the DMF-water mixture and dried in vacuum. The yield of benzidine sulfone 2 was 68.3%. 1H NMR (500 MHz, DMSO-d6, δ): 5.72, s (4H); 6.8,d (J = 8 Hz, 2H); 6.89, s (2H); 7.49, d (J = 8 Hz, 2H).13C NMR (125 MHz, DMSO-d6, δ): 105.37, 118.47,119.41, 121.44, 137.4, 149.23. IR (ν, cm-1): 3470, 3371,1609, 1481, 1351, 1315, 1261, 1308, 1153, 1131, 1031,824.
	With sulfuric acid; sulfur trioxide

Reference： [1]Mikulich; Murauski, An. A.; Muravsky, Al. A.; Agabekov [Russian Journal of Physical Chemistry, 2016, vol. 90, # 3, p. 675 - 682][Zh. Fiz. Khim., 2016, vol. 90, # 3, p. 456 - 463,8]
[2]Cullinane; Davies [Recueil des Travaux Chimiques des Pays-Bas, 1936, vol. 55, p. 881,884] Courtot; Evain [Bulletin de la Societe Chimique de France, 1931, vol. <4> 49, p. 527,528]

Yield	Reaction Conditions	Operation in experiment
	Farbrk. mit Pb²⁺;

Yield	Reaction Conditions	Operation in experiment
	With sulfuric acid
	With sulfuric acid

15
[ 6259-19-4 ]
2-hydroxy-benzidine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 180℃; beim Verschmelzen;

Reference： [1]Griess; Duisberg [Chemische Berichte, 1889, vol. 22, p. 2467]

16
[ 35242-04-7 ]
[ 6259-19-4 ]
3,7-bis(3-oxo-9-azabicyclo[3.3.1]non-9-yl)dibenzothiophene sulfone [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
60%	In methanol at 20℃; for 168000h;

Reference： [1]Nelsen, Stephen F.; Luo, Yun; Weaver, Michael N.; Lockard, Jenny V.; Zink, Jeffrey I. [Journal of Organic Chemistry, 2006, vol. 71, # 11, p. 4286 - 4295]

17
[ 1016-05-3 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: 55 percent / sulfuric acid; nitric acid / 13 h / 10 - 20 °C 2: 81.6 percent / stannous chloride; hydrochloric acid; acetic acid / 0.17 h / 70 - 80 °C
	Multi-step reaction with 2 steps 1: sulfuric acid; nitric acid 2: water; iron-powder; iron (III)-chloride

Reference： [1]Nelsen, Stephen F.; Luo, Yun; Weaver, Michael N.; Lockard, Jenny V.; Zink, Jeffrey I. [Journal of Organic Chemistry, 2006, vol. 71, # 11, p. 4286 - 4295]
[2]Cullinane et al. [Journal of the Chemical Society, 1936, p. 1435]

18
[ 92-52-4 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: water; bromine 2: chlorosulfuric acid 3: aqueous ammonia; copper (I)-chloride / 250 °C

Reference： [1]Courtot; Chang [Bulletin de la Societe Chimique de France, 1931, vol. <4>, p. 1047,1062]

19
[ 92-86-4 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: chlorosulfuric acid 2: aqueous ammonia; copper (I)-chloride / 250 °C

Reference： [1]Courtot; Chang [Bulletin de la Societe Chimique de France, 1931, vol. <4>, p. 1047,1062]

20
[ 6259-19-4 ]
[ 132-65-0 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: ethanol; NaNO₂; HCl 2: sulfur / 350 °C

Reference： [1]Cullinane; Davies [Recueil des Travaux Chimiques des Pays-Bas, 1936, vol. 55, p. 881,884]

21
[ 6259-19-4 ]
4,4'-dibromo-biphenyl-2-sulfonic acid [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: NaNO₂; HCl; copper (I)-bromide 2: sodium hydroxide; water / 200 °C

Reference： [1]Courtot; Evain [Bulletin de la Societe Chimique de France, 1931, vol. <4> 49, p. 1555,1556]

22
[ 531-86-2 ]
[ 6259-19-4 ]

Yield	Reaction Conditions	Operation in experiment
22.66 g (87%)		R.9 3,7-Diaminodibenzothiophene-5,5-dioxide REFERENCE EXAMPLE 9 3,7-Diaminodibenzothiophene-5,5-dioxide The title compound was prepared as described in U.S. Pat. Nos. 2,590,632 and 2,620,343. At 10° C., 30 g of benzidine sulfate was added, in portions, to 100 ml of fuming sulfuric acid. After the addition, the reaction was maintained at 70° C. for 18 hours, cooled and poured into 250 g of cracked ice. The beige solid was collected, washed with water and saturated sodium bicarbonate yielding a yellow solid. The yellow solid was stirred with bicarbonate solution 2*, collected, washed with large volumes of water, and dried in vacuo to give 22.66 g (87%) of the desired product.

Reference： [1]Current Patent Assignee: PFIZER INC - US6022307, 2000, A

23
[ 6259-19-4 ]
3,7-Bis(2-chloroacetamido)dibenzothiophene 5,5-dioxide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In chloroacetyl chloride; acetone	56 3,7-Bis(2-chloroacetamido)dibenzothiophene 5,5-dioxide EXAMPLE 56 3,7-Bis(2-chloroacetamido)dibenzothiophene 5,5-dioxide A slurry of 21.8 g of 3,7-diaminodibenzothiophene S,S-dioxide in 400 ml of acetone was cooled in an ice bath while 30.2 ml of chloroacetyl chloride was carefully added. The bath was removed and the mixture heated at 100° C. with stirring, then cooled and poured into ice water. The precipitate was collected, washed with water and dried giving 34.9 g of the desired product as a solid.

Reference： [1]Current Patent Assignee: PFIZER INC - US4965284, 1990, A

24
[ 6259-19-4 ]
[ 50-85-1 ]
potassium 3,7-bis(4-hydroxy-3-carboxylate-6-methylphenylazo)-5,5'-dioxodibenzothiophene [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
54%	Stage #1: 3,7-dibenzothiophenediamine, 5,5-dioxide With hydrogenchloride In water at 90℃; for 0.25h; Stage #2: With potassium nitrite In water at 0℃; for 1.5h; Stage #3: 2-hydroxy-p-toluic acid With potassium carbonate In water at 5℃;	Azo Dyes of Benzeneazo-5,5'-dioxodibenzothiophene Series We placed 2.46 g of benzidine sulfone 2, 4.8 mL (0.06 mol) of concentrated hydrochloric acid and 30 mL of distilled water into a beaker equipped with a mechanical stirrer, thermometer, and dropping funnel. The mixture was heated under stirring at 90°C for 15 min. The resulting suspension was cooled to 0°C and a solution of 1.87 g of potassium nitrite in 5 mL of water was added dropwise, followed by stirring the mixture for 1.5 h. Solution 3 of diazo salt was added dropwise to asolution of 0.022 mol of 4-methylsalicylic acid and 9.66 g (0.07 mol) of potassium carbonate in 50 mL of water at a temperature of 5°C for 45 min, and the mixture was stirred for 5 h and kept overnight. The dye was then isolated and purified according to the known procedure [14]. FtF-2. Potassium 3,7-bis(4-hydroxy-3-carboxylate-6-methylphenylazo)-5,5'-dioxodibenzothiophene(Fig. 1). Yield, 54.0%. 1H NMR (500 MHz, DMSOd6,δ): 2.65, s (6H); 6.65, s (2H); 8.24, m (6H); 8.41, d(J = 8 Hz, 2H). 13C NMR (125 MHz, DMSO-d6, δ):17.63, 112.94, 117.37, 117.67, 118.58, 124.11, 129.98,130.43, 138.89, 140.59, 144.86, 154.17, 170.53, 170.76.IR (ν, cm-1): 3424, 2923, 1634, 1582, 1492, 1456,1373, 1298, 1194, 1062, 830, 741.

25
[ 6259-19-4 ]
[ 50-85-1 ]
sodium 3,7-bis(4-hydroxy-3-carboxylate-6-methylphenylazo)-5,5'-dioxodibenzothiophene [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
50%	Stage #1: 3,7-dibenzothiophenediamine, 5,5-dioxide With hydrogenchloride In water at 90℃; for 0.25h; Stage #2: With potassium nitrite In water at 0℃; for 1.5h; Stage #3: 2-hydroxy-p-toluic acid With sodium carbonate In water at 5℃;	Azo Dyes of Benzeneazo-5,5'-dioxodibenzothiophene Series General procedure: FtF-1. Sodium 3,7-bis(4-hydroxy-3-carboxylate-6-methylphenylazo)-5,5'-dioxodibenzothiophene. The compound was synthesized and isolated via the same procedures, but sodium salts of the reagents were used. Yield, 50%. 1H NMR (500 MHz, DMSO-d6, δ): 2.65,s (6H); 6.65, s (2H); 8.24, m (6H); 8.41, d (J = 8.5 Hz,2H); 17.98, br. s (OH). 13C NMR (125 MHz, DMSOd6,δ): 17.63, 113.06, 117.39, 117.68, 118.55, 124.14,129.96, 130.47, 138.9, 140.70, 144.86, 154.15, 170.24,170.91. IR (ν, cm-1): 3424, 2922, 1634, 1582, 1532,1446, 1370, 1298, 1254, 1053, 836, 795, 731. We placed 2.46 g of benzidine sulfone 2, 4.8 mL (0.06 mol) of concentrated hydrochloric acid and 30 mL of distilled water into a beaker equipped with a mechanical stirrer, thermometer, and dropping funnel. The mixture was heated under stirring at 90°C for 15 min. The resulting suspension was cooled to 0°C and a solution of 1.87 g of potassium nitrite in 5 mL of water was added dropwise, followed by stirring the mixture for 1.5 h. Solution 3 of diazo salt was added dropwise to asolution of 0.022 mol of 4-methylsalicylic acid and 9.66 g (0.07 mol) of potassium carbonate in 50 mL of water at a temperature of 5°C for 45 min, and the mixture was stirred for 5 h and kept overnight. The dye was then isolated and purified according to the known procedure [14].

26
[ 6259-19-4 ]
C₆₀H₃₆N₆ [ No CAS ]
2C₆₀H₃₆N₆*0.85C₁₂H₁₀N₂O₂S [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In 1,4-dioxane; pentane	General procedures for preparing cage clathrates General procedure: As-synthesized cage 1 (20 mg, 24 mmol) was dissolved in 1,4-dioxane (10 mL). Theresulting suspension was filtrated through a syringe filter (polytetrafluoroethylene,pore size 0.2 mm, Whatman) to give an orange solution. The guest molecule(48 mmol) in powdered form was dissolved into the orange filtrate and the resultingmixture was divided into 10 bathes (1 mL 3 10). Slow diffusion of n-pentane into thecage-guest mixture in 1,4-dioxane afforded co-crystals of the host-guest complexesthat were suitable for SC-XRD analysis.

Reference： [1]Cooper, Andrew I.; Cui, Peng; Jelfs, Kim E.; Little, Marc A.; Ning, Guo-Hong; Pang, Zhongfu; Pegg, James T.; Sazanovich, Igor V.; Towrie, Mike; Wei, Rong-Jia; Zhu, Qiang [Chem, 2021, vol. 7, # 11, p. 3157 - 3170]

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P350	Gently wash with plenty of soap and water.
P351	Rinse cautiously with water for several minutes.
P352	Wash with plenty of soap and water.
P353	Rinse skin with water/shower.
P360	Rinse immediately contaminated clothing and skin with plenty of water before removing clothes.
P361	Remove/Take off immediately all contaminated clothing.
P362	Take off contaminated clothing and wash before reuse.
P363	Wash contaminated clothing before reuse.
P370	In case of fire:
P371	In case of major fire and large quantities:
P372	Explosion risk in case of fire.
P373	DO NOT fight fire when fire reaches explosives.
P374	Fight fire with normal precautions from a reasonable distance.
P376	Stop leak if safe to do so. Oxidising gases (section 2.4) 1
P377	Leaking gas fire: Do not extinguish, unless leak can be stopped safely.
P378
P380	Evacuate area.
P381	Eliminate all ignition sources if safe to do so.
P390	Absorb spillage to prevent material damage.
P391	Collect spillage. Hazardous to the aquatic environment
P301 + P310	IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P301 + P312	IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P301 + P330 + P331	IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.
P302 + P334	IF ON SKIN: Immerse in cool water/wrap in wet bandages.
P302 + P350	IF ON SKIN: Gently wash with plenty of soap and water.
P303 + P361 + P353	IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P304 + P312	IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell.
P304 + P340	IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P304 + P341	IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338	IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P306 + P360	IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes.
P307 + P311	IF exposed: call a POISON CENTER or doctor/physician.
P308 + P313	IF exposed or concerned: Get medical advice/attention.
P309 + P311	IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician.
P332 + P313	IF SKIN irritation occurs: Get medical advice/attention.
P333 + P313	IF SKIN irritation or rash occurs: Get medical advice/attention.
P335 + P334	Brush off loose particles from skin. Immerse in cool water/wrap in wet bandages.
P337 + P313	IF eye irritation persists: Get medical advice/attention.
P342 + P311	IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.
P370 + P376	In case of fire: Stop leak if safe to Do so.
P370 + P378	In case of fire:
P370 + P380	In case of fire: Evacuate area.
P370 + P380 + P375	In case of fire: Evacuate area. Fight fire remotely due to the risk of explosion.
P371 + P380 + P375	In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion.
Storage
Code	Phrase
P401
P402	Store in a dry place.
P403	Store in a well-ventilated place.
P404	Store in a closed container.
P405	Store locked up.
P406	Store in corrosive resistant/ container with a resistant inner liner.
P407	Maintain air gap between stacks/pallets.
P410	Protect from sunlight.
P411
P412	Do not expose to temperatures exceeding 50 oC/ 122 oF.
P413
P420	Store away from other materials.
P422
P402 + P404	Store in a dry place. Store in a closed container.
P403 + P233	Store in a well-ventilated place. Keep container tightly closed.
P403 + P235	Store in a well-ventilated place. Keep cool.
P410 + P403	Protect from sunlight. Store in a well-ventilated place.
P410 + P412	Protect from sunlight. Do not expose to temperatures exceeding 50 oC/122oF.
P411 + P235	Keep cool.
Disposal
Code	Phrase
P501	Dispose of contents/container to ...
P502	Refer to manufacturer/supplier for information on recovery/recycling

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Physical hazards
Code	Phrase
H200	Unstable explosive
H201	Explosive; mass explosion hazard
H202	Explosive; severe projection hazard
H203	Explosive; fire, blast or projection hazard
H204	Fire or projection hazard
H205	May mass explode in fire
H220	Extremely flammable gas
H221	Flammable gas
H222	Extremely flammable aerosol
H223	Flammable aerosol
H224	Extremely flammable liquid and vapour
H225	Highly flammable liquid and vapour
H226	Flammable liquid and vapour
H227	Combustible liquid
H228	Flammable solid
H229	Pressurized container: may burst if heated
H230	May react explosively even in the absence of air
H231	May react explosively even in the absence of air at elevated pressure and/or temperature
H240	Heating may cause an explosion
H241	Heating may cause a fire or explosion
H242	Heating may cause a fire
H250	Catches fire spontaneously if exposed to air
H251	Self-heating; may catch fire
H252	Self-heating in large quantities; may catch fire
H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
H270	May cause or intensify fire; oxidizer
H271	May cause fire or explosion; strong oxidizer
H272	May intensify fire; oxidizer
H280	Contains gas under pressure; may explode if heated
H281	Contains refrigerated gas; may cause cryogenic burns or injury
H290	May be corrosive to metals
Health hazards
Code	Phrase
H300	Fatal if swallowed
H301	Toxic if swallowed
H302	Harmful if swallowed
H303	May be harmful if swallowed
H304	May be fatal if swallowed and enters airways
H305	May be harmful if swallowed and enters airways
H310	Fatal in contact with skin
H311	Toxic in contact with skin
H312	Harmful in contact with skin
H313	May be harmful in contact with skin
H314	Causes severe skin burns and eye damage
H315	Causes skin irritation
H316	Causes mild skin irritation
H317	May cause an allergic skin reaction
H318	Causes serious eye damage
H319	Causes serious eye irritation
H320	Causes eye irritation
H330	Fatal if inhaled
H331	Toxic if inhaled
H332	Harmful if inhaled
H333	May be harmful if inhaled
H334	May cause allergy or asthma symptoms or breathing difficulties if inhaled
H335	May cause respiratory irritation
H336	May cause drowsiness or dizziness
H340	May cause genetic defects
H341	Suspected of causing genetic defects
H350	May cause cancer
H351	Suspected of causing cancer
H360	May damage fertility or the unborn child
H361	Suspected of damaging fertility or the unborn child
H361d	Suspected of damaging the unborn child
H362	May cause harm to breast-fed children
H370	Causes damage to organs
H371	May cause damage to organs
H372	Causes damage to organs through prolonged or repeated exposure
H373	May cause damage to organs through prolonged or repeated exposure
Environmental hazards
Code	Phrase
H400	Very toxic to aquatic life
H401	Toxic to aquatic life
H402	Harmful to aquatic life
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

[ CAS No. 6259-19-4 ] {[proInfo.proName]}

Quality Control of [ 6259-19-4 ]

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Product Details of [ 6259-19-4 ]

Calculated chemistry of [ 6259-19-4 ]

Physicochemical Properties

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Lipophilicity

Druglikeness

Water Solubility

Medicinal Chemistry

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Application In Synthesis of [ 6259-19-4 ]

[ 6259-19-4 ] Synthesis Path-Downstream 1~26

Related Functional Groups of [ 6259-19-4 ]

Amines

Sulfones

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[ 6259-19-4 ]