Butanenitrile, 4-(phenylamino)- (9CI)

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Names

[ CAS No. ]:
73747-25-8

[ Name ]:
Butanenitrile, 4-(phenylamino)- (9CI)

[Synonym ]:
N-(3-cyanopropyl)aniline
4-anilino-butyronitrile
4-(phenylamino)butyronitrile
BUTYRONITRILE,4-ANILINO
4-Anilino-butyronitril
Butanenitrile,4-(phenylamino)
3-Anilinopropyl cyanide

Chemical & Physical Properties

[ Density]:
1.055g/cm3

[ Boiling Point ]:
344.5ºC at 760 mmHg

[ Molecular Formula ]:
C10H12N2

[ Molecular Weight ]:
160.21600

[ Flash Point ]:
162.1ºC

[ Exact Mass ]:
160.10000

[ PSA ]:
35.82000

[ LogP ]:
2.47528

[ Index of Refraction ]:
1.568

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ET8850000
CHEMICAL NAME :
Butyronitrile, 4-anilino-
CAS REGISTRY NUMBER :
73747-25-8
BEILSTEIN REFERENCE NO. :
3240602
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H12-N2
MOLECULAR WEIGHT :
160.24
WISWESSER LINE NOTATION :
NC3MR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03391

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Succinonitrile
  • 4-Fluorobenzeneboronic acid
  • 6-chloro-2-phenyl-4,5-dihydro-3H-pyridazine
  • Phenylboronic acid
  • 4-Chlorobutyronitrile
  • 1,4,5,6-tetrahydro-1-phenylpyridazin-3(2H)-one
  • nitrobenzene
  • 4-Bromobutanenitrile

DownStream

  • 1-Phenylpiperidin-3-one

Related Compounds

  • 1,2-Benzenediol, 4-(phenylamino)- (9CI)
  • 1,2,3-Cyclohexanetriol, 4-(phenylamino)- (9CI)
  • 2(5H)-Furanone,3-ethyl-4-(phenylamino)-(9CI)
  • 2,5-Cyclohexadien-1-one, 2-hydroxy-4-(phenylamino)- (9CI)
  • Butanenitrile, 4-[(4-methoxy-2-methylphenyl)amino]- (9CI)
  • Butanenitrile,4,4'-(1,1,3,3-tetramethyl-1,3-disilazanediyl)bis-(9CI)
  • 4-(Furan-3-yl)-6-[(piperidin-4-yl)methoxy]pyrimidine
  • 3-{2-[Di(butan-2-yl)amino]ethyl}-1H-indol-4-ol, hydrogen chloride (1:1)
  • 4-Amino-5-(methylamino)pentanoic acid
  • 2-bromo-4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-fluorobenzoic acid
  • 2-{[(Benzyloxy)carbonyl]amino}-5-(dimethylphosphoryl)benzoic acid
  • 6-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]pyrimidine-4-carboxylic acid
  • 4-(2-{[(Tert-butoxy)carbonyl]amino}-1,3-thiazol-4-yl)thiophene-3-carboxylic acid
  • 2-[(Benzyloxy)carbonyl]-6-oxa-2-azaspiro[3.5]nonane-7-carboxylic acid
  • 4-(2-{[(Benzyloxy)carbonyl]amino}phenyl)-4-oxobutanoic acid
  • 2-Amino-3-[2-({[(benzyloxy)carbonyl]amino}methyl)phenyl]propanoic acid
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