Benzenebutanenitrile, g-oxo-a-phenyl-

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Names

[ CAS No. ]:
6268-00-4

[ Name ]:
Benzenebutanenitrile, g-oxo-a-phenyl-

[Synonym ]:
4-oxo-2,4-diphenylbutyronitrile
4-diphenylbutanenitrile
4-Oxo-2,4-diphenyl-butyronitril
3-benzoyl-2-phenylpropionitrile
EINECS 228-440-0
2,4-diphenyl-4-butyronitrilone

Chemical & Physical Properties

[ Density]:
1.126g/cm3

[ Boiling Point ]:
424.7ºC at 760 mmHg

[ Molecular Formula ]:
C16H13NO

[ Molecular Weight ]:
235.28100

[ Flash Point ]:
210.7ºC

[ Exact Mass ]:
235.10000

[ PSA ]:
40.86000

[ LogP ]:
3.56678

[ Index of Refraction ]:
1.584

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CY9040892
CHEMICAL NAME :
Benzenebutanenitrile, gamma-oxo-alpha-phenyl-
CAS REGISTRY NUMBER :
6268-00-4
BEILSTEIN REFERENCE NO. :
0649013
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H13-N-O
MOLECULAR WEIGHT :
235.30

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,57,1954

Precursor & DownStream

Precursor

DownStream

  • 3,5-diphenyl-1H-pyridazin-6-one
  • 3(2H)-Pyridazinone,4,5-dihydro-4,6-diphenyl-
  • 1H-Pyrrole,2,4-diphenyl-
  • 3,5-diphenyl-3,4-dihydro-2H-pyrrole

Related Compounds

  • Benzenebutanoic acid, g-oxo-a-phenyl-
  • Benzenebutanoic acid, g-oxo-a-phenyl-, methyl ester
  • Benzenebutanoic acid,4-chloro-g-oxo-a-phenyl-, methyl ester
  • Benzenebutanoic acid,4-amino-g-oxo-a-phenyl-
  • [1,1'-Biphenyl]-4-butanenitrile,g-oxo-a-phenyl-
  • Benzenebutanoic acid, b-bromo-4-chloro-g-oxo-a-phenyl-, methyl ester
  • 4-(3,3-Difluoropyrrolidin-1-yl)-6,7-dimethoxyquinazoline
  • (1-propyl-1H-1,2,3,4-tetrazol-5-yl)methanesulfonyl chloride
  • (3-Cyano-4-methylphenyl)methanesulfonyl chloride
  • 2-Butyl-7-methylimidazo[1,2-a]pyridine-3-sulfonyl fluoride
  • N-(4,4-dimethylpyrrolidin-3-yl)methanesulfonamide
  • [5-Chloro-6-(4-methylpiperazin-1-yl)pyridin-2-yl]methanamine
  • 2-[(Benzyloxy)methyl]-4-(propan-2-yl)pyrimidine-5-carboxylic acid
  • (1R)-1-[4-(4-methanesulfonyl-1H-pyrazol-1-yl)phenyl]propan-1-amine
  • 3-{[(2,4-Dichlorophenyl)methyl]amino}-1lambda6-thietane-1,1-dione
  • 3-(1-Aminopentan-2-yl)-1-benzylpyrrolidin-3-ol