4-Chlorobenzoylacetonitrile

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Names

[ CAS No. ]:
4640-66-8

[ Name ]:
4-Chlorobenzoylacetonitrile

[Synonym ]:
3-(4-Chlorophenyl)-3-oxopropanenitrile
4-Chlorophenacylcyanide
3-(4-Chlorphenyl)-3-oxopropanonitril
3-(4-Chloro-phenyl)-3-oxo-propionitrile
4'-Chloro-2-cyanoacetophenone
(4-Chlorobenzoyl)acetonitrile
4-Chlorobenzoylacetonitrile
MFCD00051625
Benzenepropanenitrile, 4-chloro-β-oxo-
4-Chloro benzoylacetonitrile

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
349.3±22.0 °C at 760 mmHg

[ Melting Point ]:
129-133 °C(lit.)

[ Molecular Formula ]:
C9H6ClNO

[ Molecular Weight ]:
179.603

[ Flash Point ]:
165.1±22.3 °C

[ Exact Mass ]:
179.013794

[ PSA ]:
40.86000

[ LogP ]:
1.65

[ Vapour Pressure ]:
0.0±0.8 mmHg at 25°C

[ Index of Refraction ]:
1.553

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
3276

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Ethyl 4-chlorobenzoate
  • Acetonitrile
  • 4-Chlorobenzoyl chloride
  • Cyanoacetic acid
  • Methyl 4-chlorobenzoate
  • 1-Chloro-4-iodobenzene
  • (TRIFLUOROMETHYL)DICHLOROPHOSPHINE
  • carbon monoxide
  • p-chlorobenzylalcohol

DownStream

  • 1-(4-chlorophenyl)-2-imidazolidin-2-ylideneethanone
  • 5-(4-CHLORO-PHENYL)-2-PHENYL-2H-PYRAZOL-3-YLAMINE
  • 5-Amino-3-(4-chlorophenyl)isoxazole
  • 3-(4-chlorophenyl)-1H-pyrazol-5-amine
  • N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]benzamide
  • (+)-JQ1
  • 6-amino-5-(4-chlorobenzoyl)-1-methylpyrimidin-2-one
  • 3-(4-CHLOROPHENYL)-1-METHYL-1H-PYRAZOL-5-AMINE
  • tert-butyl 4-chlorobenzoate
  • 1H-Pyrazol-5-amine, 3-(4-chlorophenyl)-1-(4-(4-chlorophenyl)-2-thiazol yl)-

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 4-Amino-2-chloro-5-(1H-tetrazol-5-yl)benzenesulfonamide
  • 4-(4-Chlorophenyl)-4-Bromopiperide
  • 4-(2-nitroimidazol-1-yl)butane-1,2-diol
  • 4-Iodo-1H-indazole-3-carboxylic acid
  • 4-chlorooxolan-3-ol,formic acid
  • 4,6-Pyrimidinedicarboxylic acid
  • 2-(4-Chloro-2-fluoro-5-methoxyphenyl)-2-oxoacetic acid
  • 2-([1,1'-Biphenyl]-2-yl)acetaldehyde
  • tert-butyl N-(4-sulfanylbutyl)carbamate
  • N-(2,4-dimethylphenyl)-2-{[1-(4-methylphenyl)-4-phenyl-1H-imidazol-2-yl]sulfonyl}acetamide
  • 3-(2,4-Dichlorophenyl)-8-methyl-1-(3,4,5-trimethoxybenzoyl)-1,4-diazaspiro[4.5]dec-3-ene-2-thione
  • 2-Isothiazolidinebutanoic acid, 1,1-dioxide
  • 5-Methyl-3-pyridin-2-yloxathiazolidine 2,2-dioxide
  • Methyl 6-chloro-1,2-dimethyl-1H-benzo[d]imidazole-5-carboxylate
  • Pyrazine, 2-chloro-5-[(3-chlorophenyl)methoxy]-3-(1-piperazinyl)-
  • CID 22489012
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