2-(4-chlorophenyl)-3-oxobutanenitrile

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Names

[ CAS No. ]:
5219-07-8

[ Name ]:
2-(4-chlorophenyl)-3-oxobutanenitrile

[Synonym ]:
einecs 226-012-8
usaf el-43

Chemical & Physical Properties

[ Density]:
1.221g/cm3

[ Boiling Point ]:
274.9ºC at 760mmHg

[ Molecular Formula ]:
C10H8ClNO

[ Molecular Weight ]:
193.63000

[ Flash Point ]:
120ºC

[ Exact Mass ]:
193.02900

[ PSA ]:
40.86000

[ LogP ]:
2.53618

[ Index of Refraction ]:
1.542

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AK6491000
CHEMICAL NAME :
Acetoacetonitrile, 2-(p-chlorophenyl)-
CAS REGISTRY NUMBER :
5219-07-8
BEILSTEIN REFERENCE NO. :
0744679
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H8-Cl-N-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689

Safety Information

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • ethyl acetate
  • 4-Chlorobenzyl cyanide
  • Acetyl chloride

DownStream

  • 1-(4-Chlorophenyl)acetone
  • 4-(4-CHLORO-PHENYL)-5-METHYL-2H-PYRAZOL-3-YLAMINE
  • 4-(4-Chlorophenyl)-3-methyl-1,2-oxazol-5-amine

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

  • 2-(4-chlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one,N-(4-hydroxyphenyl)acetamide
  • 2-(4-chlorophenyl)-3-methyl-1,3-oxazinane
  • 2-(4-chlorophenyl)-3-(4-oxo-2-phenylquinazolin-3-yl)-1,3-thiazolidin-4-one
  • 2-(4-Chlorophenyl)-3-(dimethylamino)acrylonitrile
  • 2-(4-chlorophenyl)-3,4-dihydroxy-3-methylbutanoic acid
  • 2-(4-chlorophenyl)-3-naphthalen-1-yl-prop-2-enenitrile
  • 4,4',4'',4'''-Ethenetetrayl-tetrakis-benzamidine
  • 1-{2-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclopropanecarbonyl}-4-methylpyrrolidine-3-carboxylic acid
  • rac-2-{1-[(1R,3S)-3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-2,2-difluorocyclopropyl]-N-(propan-2-yl)formamido}acetic acid
  • (2R,3S)-3-(benzyloxy)-2-{[(1RS,2SR)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cycloheptyl]formamido}butanoic acid
  • 1-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclohexanecarbonyl]-3-methylpyrrolidine-2-carboxylic acid
  • 2-{4-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanoyl]-2-oxopiperazin-1-yl}acetic acid
  • 4-Bromo-2-chloro-1-(1-ethynylcyclopropyl)benzene
  • 3-Butenyl Phosphorodichloridate
  • 1-Piperidinecarboxylic acid, 4-(2-cyanoacetyl)-, methyl ester
  • 3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[(2-hydroxy-2-methylpentan-3-yl)carbamoyl]propanoic acid
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