[ CAS No. 1007346-33-9 ] {[proInfo.proName]}

Name: 1007346-33-9|4-Bromo-1H-pyrazole-3-carbaldehyde|97%
Brand: Ambeed
SKU: A568031
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Quality Control of [ 1007346-33-9 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 1007346-33-9 ]

SDS Specification

Alternatived Products of [ 1007346-33-9 ]

Product Details of [ 1007346-33-9 ]

CAS No. :	1007346-33-9	MDL No. :	MFCD00105294
Formula :	C₄H₃BrN₂O	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	UWGFONONBAIDAF-UHFFFAOYSA-N
M.W :	174.98	Pubchem ID :	2782154
Synonyms :

Calculated chemistry of [ 1007346-33-9 ] Expand+

Physicochemical Properties

Num. heavy atoms :	8
Num. arom. heavy atoms :	5
Fraction Csp3 :	0.0
Num. rotatable bonds :	1
Num. H-bond acceptors :	2.0
Num. H-bond donors :	1.0
Molar Refractivity :	31.68
TPSA :	45.75 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	Yes
P-gp substrate :	No
CYP1A2 inhibitor :	No
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-6.87 cm/s

Lipophilicity

Log Po/w (iLOGP) :	0.42
Log Po/w (XLOGP3) :	0.7
Log Po/w (WLOGP) :	0.98
Log Po/w (MLOGP) :	-0.17
Log Po/w (SILICOS-IT) :	1.88
Consensus Log Po/w :	0.76

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	2.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-1.76
Solubility :	3.02 mg/ml ; 0.0173 mol/l
Class :	Very soluble
Log S (Ali) :	-1.24
Solubility :	10.1 mg/ml ; 0.0578 mol/l
Class :	Very soluble
Log S (SILICOS-IT) :	-2.03
Solubility :	1.63 mg/ml ; 0.00929 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	1.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	1.28

Safety of [ 1007346-33-9 ]

Signal Word:	Warning	Class:	N/A
Precautionary Statements:	P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501	UN#:	N/A
Hazard Statements:	H315-H319-H335	Packing Group:	N/A
GHS Pictogram:

Application In Synthesis of [ 1007346-33-9 ]

* 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 [ 1007346-33-9 ]

[ 1007346-33-9 ] Synthesis Path-Downstream 1~13

1
[ 1007346-33-9 ]
[ 877680-36-9 ]
4-(2,4-Dimethylphenyl)-1-(4-bromo-1H-pyrazol-5-ylmethylidene)thiosemicarbazide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
74%		57 4-(2,4-Dimethylphenyl)-1-(4-bromo-1H-pyrazol-5-ylmethylidene)thiosemicarbazide EXAMPLE 57 4-(2,4-Dimethylphenyl)-1-(4-bromo-1H-pyrazol-5-ylmethylidene)thiosemicarbazide The title compound was prepared from a mixture of 2,4-dimethylphenylthiosemicarbazide (50 mg, 0.256 mmol) and 4-bromo-1H-pyrazole-5-carboxaldehyde (54 mg, 0.31 mmol) similar to Example 3 and isolated as an off-white solid (67 mg, 74%). 1H NMR (DMSO-d6): 9.98 (s, 1H), 8.15 (s, 1H), 8.02 (s, 1H), 7.86 (s, 1H), 7.16-7.03 (m, 3H), 3.85 (m, 4H), 3.13 (m, 4H), 2.30 (s, 3H), 2.18 (s, 3H).

Reference： [1]Current Patent Assignee: IMMUNE PHARMACEUTICALS INC - US2003/45581, 2003, A1

2
[ 1007346-33-9 ]
[ 76513-69-4 ]
[ 1007346-34-0 ]

Yield	Reaction Conditions	Operation in experiment
69%	Stage #1: 4-bromo-1H-pyrazole-5-carboxaldehyde With sodium hydride In tetrahydrofuran at 0℃; for 0.166667h; Stage #2: (2-trimethylethylsilylethoxy)methyl chloride In tetrahydrofuran for 2h;	116.1 Preparation of 4-bromo-l-{ [2- (trimethylsilyl) ethoxy]methyl}- lH-pyrazole-5-carbaldehyde To a stirred suspension of 4-bromo-lH-pyrazole-5- carbaldehyde (1.93 g, 11 iranol) in THF (50 mL) was added sodium hydride (0.484 g, 12.1 mmol) at 00C. After 10 min, [2-(chloromethoxy)ethyl] (trimethyl) silane (2.34 mL, 13.2 mmol) was added. After 2 h, the mixture was poured into saturated aqueous NaHCO3 and extracted with EtOAc (100 mL) , and the extract was dried over MgSO4, filtered and concentrated under reduced pressure. The residue was purified by column chromatography (Purif, silica gel, hexane to 80:20 hexane/EtOAc) to afford the title compound (2.30 g, 69%) as a colorless oil:1H NMR (300 MHz, CDCl3) δ 0.00 (9H, s) , 0.94 (2H, t, J = 8.1 Hz), 3.60 (2H, t, J = 8.1 Hz), 5.48 (2H, s) , 7.70 (IH, s) , 10.00 (IH, s).
39%	With sodium hydride In N,N-dimethyl-formamide at 20℃; for 18h;

Reference： [1]Current Patent Assignee: TAKEDA PHARMACEUTICAL COMPANY LIMITED - WO2010/101302, 2010, A1 Location in patent: Page/Page column 219
[2]Lee, Yu-Kai; Parks, Daniel J.; Lu, Tianbao; Thieu, Tho V.; Markotan, Thomas; Pan, Wenxi; McComsey, David F.; Milkiewicz, Karen L.; Crysler, Carl S.; Ninan, Nisha; Abad, Marta C.; Giardino, Edward C.; Maryanoff, Bruce E.; Damiano, Bruce P.; Player, Mark R. [Journal of Medicinal Chemistry, 2008, vol. 51, # 2, p. 282 - 297]

3
[ 1007346-33-9 ]
[ 959756-34-4 ]

Yield	Reaction Conditions	Operation in experiment
	With sodium tetrahydroborate; acetic acid In isopropyl alcohol	25 EXAMPLE 25 The tert-butyl 4-[4-bromo-3-(hydroxymethyl)pyrazol-1-yl]piperidine-1-carboxylate used as starting materials were made as follows: Sodium tetrahydroborate (35.7 mg) was added to 4-bromo-2H-pyrazole-3-carbaldehyde (150 mg) suspended in 2-propanol (10 ml). The resulting suspension was stirred at 25° C. for 1 hour. A few drops of acetic acid were added and the solution was concentrated to dryness. The crude product was purified by flash chromatography on silica gel eluding with 100% ethyl acetate. The solvent was evaporated to dryness to afford (4-bromo-2H-pyrazol-3-yl)methanol (110 mg). NMR Spectrum: (DMSO-d6+TFAd) 4.44 (s, 2H), 7.69 (s, 1H); Mass spectrum: M+H+ 177-179.
	With sodium tetrahydroborate In tetrahydrofuran at 50℃; for 1h;	12.1 (4-Bromo-1H-pyrazol-5-yl)methanol Sodium tetrahydroborate (0.13 g, 3.4 mmol) was added to a solution of 4-bromo-1H-pyrazole-5-carbaldehyde (0.30 g, 1.7 mmol, from Maybridge) in tetrahydrofuran (5 mL). The reaction mixture was stirred at 50° C. for 1 h. The reaction mixture was quenched with saturated aqueous NaHCO3, and extracted with ethyl acetate (3×20 mL). The combined organic layers were washed with brine, dried over MgSO4, filtered and concentrated under reduced pressure to afford the crude product which was directly used in the next step reaction without further purification. LCMS calculated for C4H6BrN2O (M+1)+: m/z=177.0. Found: 176.9.

Reference： [1]Current Patent Assignee: ASTRAZENECA PLC - US2009/118305, 2009, A1
[2]Current Patent Assignee: INCYTE CORP - US2014/343030, 2014, A1 Location in patent: Paragraph 0474; 0475

4
[ 1007346-33-9 ]
[ 141699-59-4 ]
[ 1146951-48-5 ]

Yield	Reaction Conditions	Operation in experiment
	With potassium carbonate In acetonitrile	60 1-[4-[6-amino-5-(1,3-benzoxazol-2-yl)-3-pyridyl]-1-(4-piperidyl)pyrazol-3-yl]ethanol The tert-butyl 4-[4-[6-amino-5-(1,3-benzoxazol-2-yl)-3-pyridyl]-3-(1-hydroxyethyl)pyrazol-1-yl]piperidine-1-carboxylate used as starting material was prepared as follows: 4-bromo-2H-pyrazole-3-carbaldehyde (3 g), potassium carbonate (3.32 g) and tert-butyl 4-methylsulfonyloxypiperidine-1-carboxylate (6.23 g) in acetonitrile (150 ml) were stirred at reflux overnight. The resulting precipitate was removed by filtration and the filtrate was concentrated and purified by flash chromatography on silica gel eluding with 0 to 20% ethyl acetate in petroleum ether.

Reference： [1]Current Patent Assignee: ASTRAZENECA PLC - US2009/118305, 2009, A1

5
[ 1007346-33-9 ]
(R)-2-(benzylamino)propan-1-ol-2-d [ No CAS ]
(R)-2-(benzyl((4-bromo-1H-pyrazol-5-yl)methyl)amino)propan-1-ol-2-D [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
79%	With sodium tris(acetoxy)borohydride; acetic acid In 1,2-dichloro-ethane at 25℃; for 2.5h;

Reference： [1]Barsanti, Paul A.; Aversa, Robert J.; Jin, Xianming; Pan, Yue; Lu, Yipin; Elling, Robert; Jain, Rama; Knapp, Mark; Lan, Jiong; Lin, Xiaodong; Rudewicz, Patrick; Sim, Janet; Taricani, Lorena; Thomas, George; Xiao, Linda; Yue, Qin [ACS Medicinal Chemistry Letters, 2015, vol. 6, # 1, p. 37 - 41]

6
[ 287917-97-9 ]
[ 74609-49-7 ]
(R)-2-(benzyl((4-bromo-1H-pyrazol-5-yl)methyl)amino)propan-1-ol [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
73%	With sodium tris(acetoxy)borohydride; at 20℃; for 3h;	(R)-2-(Benzylamino)propan-1-ol (800 mg, 4.8 mmol)And 3-aldehyde-4-bromopyrazole (703 mg, 4 mmol) were added to a solution of 1,1-dichloroethane (15 mL), respectively.Sodium triacetoxyborohydride (2.55 g, 12 mmol) was then added to the reaction mixture and allowed to react at room temperature for 3 h.The reaction mixture was diluted with water and extracted with dichloromethane (3×).The organic phase is filtered, concentrated under reduced pressure and purified by silica gel column to give product(R)-2-(Benzyl((4-bromo-1H-pyrazol-5-yl)methyl)amino)propan-1-ol (905 mg, yield 73%).
70%	With sodium tris(acetoxy)borohydride; In methanol; at 20℃; for 2h;	4-bromopyrazole-5-carboxaldehyde (875 mg, 5 mmol) and <strong>[74609-49-7](R)-2-(benzylamino)propan-1-ol</strong> (996 mg, 6 mmol) were added to a solution of methanol (20 mL). Sodium triacetoxyborohydride (3.18 g, 15 mmol) was then added to the reaction mixture. After reacting for 3 h at room temperature, the reaction mixture was diluted with water and extracted three times with ethyl acetate. The organic phase was combined and dried over anhydrous Na2SO4. (R)-2-(Benzyl((4-bromo-1H-pyrazol-5-yl)methyl)amino)propan-1-ol (1.13 g, yield 70%).

Reference： [1]Patent: CN110183471,2019,A .Location in patent: Paragraph 0025
[2]Patent: CN110156816,2019,A .Location in patent: Paragraph 0025
[3]ACS Medicinal Chemistry Letters,2015,vol. 6,p. 37 - 41

7
[ 287917-97-9 ]
[ 115643-59-9 ]
C₁₁H₆BrFN₄O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With sodium metabisulfite; In N,N-dimethyl acetamide; for 5h;Inert atmosphere; Reflux;	Under the argon 2-amino-6-fluoro-benzamide (77 mg, 0 . 50mmol) dissolved in dimethylacetamide (5 ml) in, by adding 4-bromo -1H-pyrazole-5-formaldehyde (88 mg, 0 . 50mmol) and Na 2 S 2 O 5 (143 mg, 0 . 75mmol), and the mixture stirred under the reflow conditions for 5 hours. After the cooling to room temperature, the reaction mixture is concentrated, and dissolved in acetonitrile and N, N-dimethyl formamide in a mixture. Filtered and thoroughly drying the remaining solid, get colorless solid 2 - (4-bromo -1H-pyrazol-5-yl) - 5- [...] -4 (3H)-one (30 mg, of the setpoint value of 19%). 1 HNMR (400MHz, d 6-DMSOdelta, PPM) 13.91 (br.s, 1H, NH), 12.03 (br.s, 1H, NH), 8.22 (s, 1H), 7.80 (dd, 1H), 7.51 (d, 1H), 7.27 (dd, 1H).

Reference： [1]Patent: CN103228141,2016,B .Location in patent: Paragraph 0176-0178

8
[ 1007346-33-9 ]
C₅₁H₇₉N₁₂O₂₁PS [ No CAS ]
C₅₅H₈₀BrN₁₄O₂₁PS [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid In dimethyl sulfoxide at 20℃; for 24h;

Reference： [1]Hogan, Megan; Bahta, Medhanit; Tsuji, Kohei; Nguyen, Trung X.; Cherry, Scott; Lountos, George T.; Tropea, Joseph E.; Zhao, Bryan M.; Zhao, Xue Zhi; Waugh, David S.; Burke, Terrence R.; Ulrich, Robert G. [ACS Combinatorial Science, 2019, vol. 21, # 3, p. 158 - 170]

9
[ 1007346-33-9 ]
C₅₂H₈₃N₁₂O₁₉PS [ No CAS ]
C₅₆H₈₄BrN₁₄O₁₉PS [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid In dimethyl sulfoxide at 20℃; for 24h;

10
[ 1007346-33-9 ]
C₅₃H₈₃N₁₂O₂₁PS [ No CAS ]
C₅₇H₈₄BrN₁₄O₂₁PS [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid In dimethyl sulfoxide at 20℃; for 24h;

11
[ 1007346-33-9 ]
C₅₂H₈₃N₁₂O₁₉PS [ No CAS ]
C₅₆H₈₄BrN₁₄O₁₉PS [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid In dimethyl sulfoxide at 20℃; for 24h;

12
[ 1007346-33-9 ]
C₅₁H₈₁N₁₂O₁₉PS [ No CAS ]
C₅₅H₈₂BrN₁₄O₁₉PS [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid In dimethyl sulfoxide at 20℃; for 24h;

13
[ 1007346-33-9 ]
C₅₀H₇₇N₁₂O₂₁PS [ No CAS ]
C₅₄H₇₈BrN₁₄O₂₁PS [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid In dimethyl sulfoxide at 20℃; for 24h;

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Isomers

Technical Information

• 1,4-Addition of an Amine to a Conjugated Enone • 1,4-Addition of an Amine to a Conjugated Enone • 1,4-Additions of Organometallic Reagents • Acetal Formation • Acid-Catalyzed α -Halogenation of Ketones • Add Hydrogen Cyanide to Aldehydes and Ketones to Produce Alcohols • Addition of a Hydrogen Halide to an Internal Alkyne • Alcohol Syntheses from Aldehydes, Ketones and Organometallics • Alcohols from Haloalkanes by Acetate Substitution-Hydrolysis • Alcohols React with PX3 • Aldehydes and Ketones Form Hemiacetals Reversibly • Aldehydes May Made by Terminal Alkynes Though Hydroboration-oxidation • Aldol Addition • Aldol Condensation • Alkenes React with Ozone to Produce Carbonyl Compounds • Alkyl Halide Occurrence • Alkylation of Aldehydes or Ketones • Alkylation of an Alkynyl Anion • Amides Can Be Converted into Aldehydes • An Alkane are Prepared from an Haloalkane • Barbier Coupling Reaction • Baylis-Hillman Reaction • Bucherer-Bergs Reaction • Clemmensen Reduction • Complex Metal Hydride Reductions • Conjugated Enone Takes Part in 1,4-Additions • Convert Aldonic Acid into the Lower Aldose by Oxidative Decarboxylation • Convert Esters into Aldehydes Using a Milder Reducing Agent • Convert Haloalkanes into Alcohols by SN2 • Corey-Chaykovsky Reaction • Corey-Fuchs Reaction • Cyanohydrins can be Convert to Carbonyl Compounds under Basic Conditions • Deoxygenation of the Carbonyl Group • Deprotonation of a Carbonyl Compound at the α -Carbon • DIBAL Attack Nitriles to Give Ketones • Dithioacetal Formation • Enamine Formation • Enamines Can Be Used to Prepare Alkylated Aldehydes • Enol-Keto Equilibration • Exclusive 1,4-Addition of a Lithium Organocuprate • Fischer Indole Synthesis • Friedel-Crafts Alkylation of Benzene with Haloalkanes • General Reactivity • Grignard Reaction • Halogenation of Alkenes • Hantzsch Dihydropyridine Synthesis • Hemiaminal Formation from Amines and Aldehydes or Ketones • Hemiaminal Formation from Amines and Aldehydes or Ketones • Henry Nitroaldol Reaction • HIO4 Oxidatively Degrades Vicinal Diols to Give Carbonyl Derivatives • Hiyama Cross-Coupling Reaction • Horner-Wadsworth-Emmons Reaction • Hydration of the Carbonyl Group • Hydride Reductions • Hydride Reductions of Aldehydes and Ketones to Alcohols • Hydride Reductions of Aldehydes and Ketones to Alcohols • Hydroboration of a Terminal Alkyne • Hydrogenation by Palladium on Carbon Gives the Saturated Carbonyl Compound • Hydrolysis of Imines to Aldehydes and Ketones • Imine Formation from Amines and Aldehydes or Ketones • Julia-Kocienski Olefination • Kinetics of Alkyl Halides • Knoevenagel Condensation • Kumada Cross-Coupling Reaction • Leuckart-Wallach Reaction • Lithium Organocuprate may Add to the α ,β -Unsaturated Carbonyl Function in 1,4-Fashion • McMurry Coupling • Meerwein-Ponndorf-Verley Reduction • Methylation of Ammonia • Methylation of Ammonia • Mukaiyama Aldol Reaction • Nozaki-Hiyama-Kishi Reaction • Oxidation of Alcohols to Carbonyl Compounds • Oxidation of Aldehydes Furnishes Carboxylic Acids • Passerini Reaction • Paternò-Büchi Reaction • Periodic Acid Degradation of Sugars • Petasis Reaction • Phenylhydrazone and Phenylosazone Formation • Pictet-Spengler Tetrahydroisoquinoline Synthesis • Preparation of Aldehydes and Ketones • Preparation of Amines • Prins Reaction • Pyrroles, Furans, and Thiophenes are Prepared from γ-Dicarbonyl Compounds • Reactions of Aldehydes and Ketones • Reactions of Alkyl Halides with Reducing Metals • Reactions of Amines • Reactions of Dihalides • Reduction of an Ester to an Aldehyde • Reductive Amination • Reformatsky Reaction • Schlosser Modification of the Wittig Reaction • Schmidt Reaction • Selective Eduction of Acyl Chlorides to Produce Aldehydes • Stetter Reaction • Stille Coupling • Stobbe Condensation • Strecker Synthesis • Substitution and Elimination Reactions of Alkyl Halides • Suzuki Coupling • Synthesis of 2-Amino Nitriles • Tebbe Olefination • The Cycloaddition of Dienes to Alkenes Gives Cyclohexenes • The Wittig Reaction • Thiazolium Salt Catalysis in Aldehyde Coupling • Thiazolium Salts Catalyze Aldehyde Coupling • Thiazolium Salts Catalyze Aldehyde Coupling • Ugi Reaction • Use 1,3-dithiane to Prepare of α-Hydroxyketones • Williamson Ether Syntheses • Wittig Reaction • Wolff-Kishner Reduction

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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

Purity	Size	Price	VIP Price	USA Stock *0-1 Day	Global Stock *5-7 Days	Quantity
{[ item.p_purity ]}	{[ item.pr_size ]}	Inquiry	{[ getRatePrice(item.pr_usd, 1,1,item.pr_is_large_size_no_price) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate,item.pr_is_large_size_no_price) ]}	{[ getRatePrice(item.pr_usd, 1,1,item.pr_is_large_size_no_price) ]}	Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate,item.pr_is_large_size_no_price) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate,item.pr_is_large_size_no_price) ]}	{[ item.pr_usastock ]}		{[ item.pr_chinastock ]}	{[ item.pr_remark ]}

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. 1007346-33-9 ] {[proInfo.proName]}

Quality Control of [ 1007346-33-9 ]

Related Doc. of [ 1007346-33-9 ]

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Physicochemical Properties

Pharmacokinetics

Lipophilicity

Druglikeness

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Medicinal Chemistry

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Application In Synthesis of [ 1007346-33-9 ]

[ 1007346-33-9 ] Synthesis Path-Downstream 1~13

Technical Information

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Physical hazards

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