[ CAS No. 770718-92-8 ] {[proInfo.proName]}

Name: 770718-92-8|3-Bromo-5-hydroxybenzonitrile|98%
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SKU: A198034
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Quality Control of [ 770718-92-8 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 770718-92-8 ]

SDS Specification

Alternatived Products of [ 770718-92-8 ]

Product Details of [ 770718-92-8 ]

CAS No. :	770718-92-8	MDL No. :	MFCD16659096
Formula :	C₇H₄BrNO	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	CFHJXQLPUIYWNM-UHFFFAOYSA-N
M.W :	198.02	Pubchem ID :	18440043
Synonyms :

Calculated chemistry of [ 770718-92-8 ]

Physicochemical Properties

Num. heavy atoms :	10
Num. arom. heavy atoms :	6
Fraction Csp3 :	0.0
Num. rotatable bonds :	0
Num. H-bond acceptors :	2.0
Num. H-bond donors :	1.0
Molar Refractivity :	40.88
TPSA :	44.02 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	Yes
P-gp substrate :	No
CYP1A2 inhibitor :	Yes
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	Yes
Log Kp (skin permeation) :	-6.1 cm/s

Lipophilicity

Log Po/w (iLOGP) :	1.52
Log Po/w (XLOGP3) :	1.98
Log Po/w (WLOGP) :	2.03
Log Po/w (MLOGP) :	1.55
Log Po/w (SILICOS-IT) :	2.0
Consensus Log Po/w :	1.81

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	1.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-2.76
Solubility :	0.345 mg/ml ; 0.00174 mol/l
Class :	Soluble
Log S (Ali) :	-2.53
Solubility :	0.584 mg/ml ; 0.00295 mol/l
Class :	Soluble
Log S (SILICOS-IT) :	-2.77
Solubility :	0.34 mg/ml ; 0.00172 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	0.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	1.74

Safety of [ 770718-92-8 ]

Signal Word:	Warning	Class:
Precautionary Statements:	P280-P305+P351+P338	UN#:
Hazard Statements:	H302-H315-H319-H335	Packing Group:
GHS Pictogram:

Application In Synthesis of [ 770718-92-8 ]

* 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.

Upstream synthesis route of [ 770718-92-8 ]
Downstream synthetic route of [ 770718-92-8 ]

[ 770718-92-8 ] Synthesis Path-Upstream 1~1

1
[ 867366-91-4 ]
[ 770718-92-8 ]

Yield	Reaction Conditions	Operation in experiment
89%	Stage #2: With lithium iodide In 2,3,4-lutidine at 150℃;	Anhydrous collidine (100 mL) was added to a dry flask containing 180c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150° C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO₄). Concentration in vacuo afforded 8.7 g (89percent) of 182.
89%	Stage #1: With lithium iodide In 2,4,6-trimethyl-pyridine at 150℃; Stage #2: With hydrogenchloride In 2,4,6-trimethyl-pyridine; water at 0℃;	Anhydrous collidine (100 mL) was added to a dry flask containing 46c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150° C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO₄). Concentration in vacuo afforded 8.7 g (89percent) of 48.
89%	at 150℃;	Anhydrous collidine (100 mL) was added to a dry flask containing R-21c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150° C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO₄). Concentration in vacuo afforded 8.7 g (89percent) of R-22.

89%	at 150℃;	step 3-Anhydrous collidine (100 mL) was added to a dry flask containing 3-bromo-5-methoxy-benzonitrile (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150° C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO₄). Concentration in vacuo afforded 8.7 g (89percent) of 3-bromo-5-hydroxy-benzonitrile.
89%	Stage #1: With 2,4,6-trimethyl-pyridine; lithium iodide In 2,4,6-trimethyl-pyridine at 150℃; Stage #2: With hydrogenchloride In water at 0℃;	Anhydrous collidine (100 mL) was added to a dry flask containing 3-bromo-5-methoxy-benzonitrile (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150° C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO₄). Concentration in vacuo afforded 8.7 g (89percent) of 3-bromo-5-hydroxy-benzonitrile.
89%	at 150℃;	step 3-Anhydrous collidine (100 mL) was added to a dry flask containing R-21c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150° C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO₄). Concentration in vacuo afforded 8.7 g (89percent) of R-22.

Reference： [1] Patent: US2005/239881, 2005, A1, . Location in patent: Page/Page column 47-48
[2] Patent: US2008/20981, 2008, A1, . Location in patent: Page/Page column 19
[3] Patent: US2008/45511, 2008, A1, . Location in patent: Page/Page column 21
[4] Patent: US2008/293664, 2008, A1, . Location in patent: Page/Page column 16
[5] Patent: US2008/249151, 2008, A1, . Location in patent: Page/Page column 21
[6] Patent: US2009/170856, 2009, A1, . Location in patent: Page/Page column 23
[7] Patent: US2004/198736, 2004, A1, . Location in patent: Page/Page column 80; 81

[ 770718-92-8 ] Synthesis Path-Downstream 1~7

1
[ 867366-91-4 ]
[ 770718-92-8 ]

Yield	Reaction Conditions	Operation in experiment
89%		Anhydrous collidine (100 mL) was added to a dry flask containing 180c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150 C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO4). Concentration in vacuo afforded 8.7 g (89%) of 182.
89%		Anhydrous collidine (100 mL) was added to a dry flask containing 46c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150 C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO4). Concentration in vacuo afforded 8.7 g (89%) of 48.
89%	With lithium iodide; at 150℃;	Anhydrous collidine (100 mL) was added to a dry flask containing R-21c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150 C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO4). Concentration in vacuo afforded 8.7 g (89%) of R-22.

89%	With 2,3,5-trimethyl-pyridine; lithium iodide; at 150℃;	step 3-Anhydrous collidine (100 mL) was added to a dry flask containing <strong>[867366-91-4]3-bromo-5-methoxy-benzonitrile</strong> (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150 C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO4). Concentration in vacuo afforded 8.7 g (89%) of 3-bromo-5-hydroxy-benzonitrile.
89%		Anhydrous collidine (100 mL) was added to a dry flask containing <strong>[867366-91-4]3-bromo-5-methoxy-benzonitrile</strong> (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150 C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO4). Concentration in vacuo afforded 8.7 g (89%) of 3-bromo-5-hydroxy-benzonitrile.
89%	With 2,3,5-trimethyl-pyridine; lithium iodide; at 150℃;	step 3-Anhydrous collidine (100 mL) was added to a dry flask containing R-21c (10.4 g, 49 mmol) and LiI (19.6 g, 3 equiv). The solution was heated under nitrogen to 150 C. overnight, cooled to RT, and poured into an ice cold 1 M HCl solution. The mixture was extracted with a 1:1 EtOAc/hexanes solution, washed with water, and dried (MgSO4). Concentration in vacuo afforded 8.7 g (89%) of R-22.
75%	With boron tribromide; In dichloromethane; at 0 - 25℃;	To a solution of <strong>[867366-91-4]3-bromo-5-methoxybenzonitrile</strong> (10 g, 4.7 mmol) in DCM (300 niL) was added BBr3 (35 g, 14 mmol) dropwise at 0C. After stirring for 1.5 hours, the ice-bath was removed and the mixture was stirred at 25C ovemight. After TLC showed the starting material was consumed completely, the mixture was quenched with MeOH and concentrated to afford the crude Intermediate 17 A, which was used in the next step directly (7.0 g, 75%). l NMR (CD3OD) 57.32 (s, 1 H),7.24 (s, 1 H), 7.05 (s, 1 H).
		Step 2 A solution of 3-bromo-5-methoxybenzaldehyde (4.02 g, 18.7 mmol) and hydroxylamine hydrochloride (6.50 g, 93.5 mmol) in pyridine (50 ML) and EtOH (50 ML) was heated to 65 C. for 16 h.The solvent was removed, and the remaining materials were partitioned between 1:1 EtOAc/hexanes (150 ML) and H2O (75 ML).The organic layer was washed with brine (60 ML), and the solvents were evaporated.The remaining oil was dissolved in anhydrous dioxane (50 ML), and trifluoroacetic anhydride (5.1 ML, 37.4 mmol) and pyridine (9.07 ML, 112.2 mmol) were added.The mixture was heated to 60 C. for 3 h and then cooled to RT. CHCl3 (100 ML) was added, and the organic layer was washed with H2O (250 ML), 5% aqueous HCl solution (30 ML), brine (30 ML), and dried with anhydrous MgSO4.The solvents were removed to provide a white solid.This solid was placed in a 150 ML flask that was flushed with nitrogen.Collidine (40 ML) and LiI (7.92 g, 59.10 mmol) were added, and the mixture was heated to 180 C. for 5 h.The reaction mixture was cooled to RT, and partitioned between H2O (400 ML) and EtOAc (100 ML).The layers were separated, and the aqueous layer was acidified with 10% aqueous HCl solution, and extracted with 2:1 EtOAc/hexanes (3125 ML).The combined organic layers were washed with H2O (100 ML), 10% aqueous HCl solution (2*50 ML), brine (75 ML), and dried with anhydrous MgSO4.The solvents were evaporated and the resulting solid was purified by flash chromatography on silica gel (10% to 40% EtOAc/hexanes) to provide 3.40 g (92%) of 3-bromo-5-hydroxybenzonitrile (116)116).

Reference： [1]Patent: US2005/239881,2005,A1 .Location in patent: Page/Page column 47-48
[2]Patent: US2008/20981,2008,A1 .Location in patent: Page/Page column 19
[3]Patent: US2008/45511,2008,A1 .Location in patent: Page/Page column 21
[4]Patent: US2008/293664,2008,A1 .Location in patent: Page/Page column 16
[5]Patent: US2008/249151,2008,A1 .Location in patent: Page/Page column 21
[6]Patent: US2009/170856,2009,A1 .Location in patent: Page/Page column 23
[7]Patent: WO2018/5801,2018,A2 .Location in patent: Page/Page column 115
[8]Patent: US2004/198736,2004,A1 .Location in patent: Page/Page column 80; 81

2
[ 317356-84-6 ]
[ 770718-92-8 ]
[ 770718-93-9 ]

Yield	Reaction Conditions	Operation in experiment
62%		Step 3 solid sodium tert-butoxide (1.67 g, 16.50 mmol) was added in three portions to a solution of <strong>[770718-92-8]3-bromo-5-hydroxybenzonitrile</strong> (3.27 g, 16.50 mmol) in anhydrous THF (40 ML) under nitrogen.The resulting heterogeneous solution was aged at RT for 15 m.The solution was cooled to 0 C, and a solution of the ester (4.04 g, 13.71 mmol) was added dropwise over 30 m.The purple mixture was warmed to RT, stirred for 16 h, and then added to a saturated aqueous solution of NH4Cl (100 ML).The mixture was extracted with ethyl ether (3100 ML), and the combined organics were washed with brine (1100 ML) and dried over anhydrous MgSO4.The solvents were evaporated, and the remaining solid was purified by crystallization from 1:1 EtOAc/hexanes to provide 4.34 g (62%) of [3-(3-bromo-5-cyano-phenoxy)-2-fluoro-4-nitro-phenyl]-acetic acid ethyl ester (117a)117a).

Reference： [1]Patent: US2004/198736,2004,A1 .Location in patent: Page/Page column 81

3
[ 700370-33-8 ]
[ 770718-92-8 ]
(R)-4'-(5-((1H-1,2,3-triazol-1-yl)methyl)-2-oxooxazolidin-3-yl)-2'-fluoro-5-hydroxy-[1,1'-biphenyl]-3-carbonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
90%	With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate; In 1,4-dioxane; ethanol; water; at 90 - 95℃; for 3h;Inert atmosphere;	General procedure: A mixture of the desired aryl boronic ester/ or acid (1 mmol) and the desired aryl bromide (1 mmol), Pd(dppf)2Cl2 (0.05 mmol) and K2CO3 (4 mmol) in dioxane (3 mL), EtOH (1 mL) and H2O ( 1 mL) was added to a nitrogen purged 25 mL flask. The mixture was heated to 90-95 C and stirred for 3 hrs. Then cooled to room temperature, filtrated and evaporated to dryness. Then the crude was dissolved in DMF (1 mL), and then it was purified by reversed phase column chromatography on prep- HPLC using gradient of (water/acetonitrile/ 0.1 %TFA). Those fractions containing pure product were pooled and lyophilized to give the pure products.

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2017,vol. 27,p. 5310 - 5321

4
[ 770718-92-8 ]
(R)-5-((2H-1,2,3-triazol-2-yl)methyl)-3-(3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)oxazolidin-2-one [ No CAS ]
(R)-4'-(5-((2H-1,2,3-triazol-2-yl)methyl)-2-oxooxazolidin-3-yl)-2'-fluoro-5-hydroxy-[1,1'-biphenyl]-3-carbonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
89%	With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate; In 1,4-dioxane; ethanol; water; at 90 - 95℃; for 3h;Inert atmosphere;	General procedure: A mixture of the desired aryl boronic ester/ or acid (1 mmol) and the desired aryl bromide (1 mmol), Pd(dppf)2Cl2 (0.05 mmol) and K2CO3 (4 mmol) in dioxane (3 mL), EtOH (1 mL) and H2O ( 1 mL) was added to a nitrogen purged 25 mL flask. The mixture was heated to 90-95 C and stirred for 3 hrs. Then cooled to room temperature, filtrated and evaporated to dryness. Then the crude was dissolved in DMF (1 mL), and then it was purified by reversed phase column chromatography on prep- HPLC using gradient of (water/acetonitrile/ 0.1 %TFA). Those fractions containing pure product were pooled and lyophilized to give the pure products.

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2017,vol. 27,p. 5310 - 5321

5
[ 770718-92-8 ]
3-(benzyloxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile [ No CAS ]

Reference： [1]Patent: WO2018/5801,2018,A2

6
[ 770718-92-8 ]
3-(benzyloxy)-5-(3-ethylpyridin-4-yl)benzonitrile [ No CAS ]

Reference： [1]Patent: WO2018/5801,2018,A2

7
[ 770718-92-8 ]
[ 100-44-7 ]
3-(benzyloxy)-5-bromobenzonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
98%	With potassium carbonate; In acetonitrile;Reflux;	To a solution of Intermediate 17A (7.0 g, 36 mmol) in CH3CN (100 mL) was added K2C03(9.8 g, 71 mmol) and BnCl (5.4 g, 43 mmol) and the mixture was stirred at reflux overnight. After LCMS showed the starting material was consumed completely, the reaction mixture was filtered and the filtrate was concentrated to give the crude product, which was purified by silica gel chromatography (2-10% EtOAc/Petroleum Ether) to give Intermediate 17B (10 g, 98%). NMR (CDC13) delta 7.29-7.36 (m, 7 H), 7.08 (s, 1 H), 5.00 (s, 2 H).

Reference： [1]Patent: WO2018/5801,2018,A2 .Location in patent: Page/Page column 115; 116

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Ghs Precautionary Statements

Precautionary Statements-General
Code	Phrase
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Code	Phrase
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P220	Keep/Store away from clothing/combustible materials.
P221	Take any precaution to avoid mixing with combustibles
P222	Do not allow contact with air.
P223	Keep away from any possible contact with water, because of violent reaction and possible flash fire.
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P321
P322
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P378
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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.
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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.
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P370 + P378	In case of fire:
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P371 + P380 + P375	In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion.
Storage
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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
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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. 770718-92-8 ] {[proInfo.proName]}

Quality Control of [ 770718-92-8 ]

Related Doc. of [ 770718-92-8 ]

Product Details of [ 770718-92-8 ]

Calculated chemistry of [ 770718-92-8 ]

Physicochemical Properties

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Lipophilicity

Druglikeness

Water Solubility

Medicinal Chemistry

Safety of [ 770718-92-8 ]

Application In Synthesis of [ 770718-92-8 ]

[ 770718-92-8 ] Synthesis Path-Upstream 1~1

[ 770718-92-8 ] Synthesis Path-Downstream 1~7

Related Functional Groups of [ 770718-92-8 ]

Aryls

Bromides

Nitriles

Precautionary Statements-General

Prevention

Response

Storage

Disposal

Physical hazards

Health hazards

Environmental hazards

Inquiry

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[ 770718-92-8 ]