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
  • N-({[3,3'-bithiophene]-5-yl}methyl)cyclobutanecarboxamide
  • [({[3,3'-Bithiophene]-5-yl}methyl)carbamoyl]methyl acetate
  • 1-(3-{[(5-bromopyrimidin-2-yl)oxy]methyl}piperidin-1-yl)-2-(1-methyl-1H-indol-3-yl)ethan-1-one
  • 6-(3,5-Dimethylpyrazol-1-yl)-2-(1-quinolin-2-ylpiperidin-4-yl)pyridazin-3-one
  • (2R)-2-(2,2,3,3-Tetrafluorocyclobutyl)propan-1-amine
  • 6-(3,5-Dimethylpyrazol-1-yl)-2-(1-quinolin-4-ylpiperidin-4-yl)pyridazin-3-one
  • 6-(3,5-Dimethylpyrazol-1-yl)-2-[1-(3-methylquinoxalin-2-yl)piperidin-4-yl]pyridazin-3-one
  • 1-(4-Cyclopropylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
  • 8-({4-[(Pyrimidin-2-yloxy)methyl]piperidin-1-yl}sulfonyl)quinoline
  • tert-butyl 4-{[6-(3,5-dimethyl-1H-pyrazol-1-yl)pyridazin-3-yl]oxy}piperidine-1-carboxylate
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