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Substance Name: N-(2-Cyanoethyl)-2-phenylethylamine
RN: 148-87-8
UNII: 465EKH3OG1
InChIKey: WYRNRZQRKCXPLA-UHFFFAOYSA-N

Note

  • Prodrug of 2-phenylethylamine.

Molecular Formula

  • C11-H14-N2

Molecular Weight

  • 174.246
 
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Names and Synonyms

Name of Substance

  • N-(2-Cyanoethyl)-2-phenylethylamine

Synonyms

  • 3-(Ethylphenylamino)propanenitrile
  • 3-(Ethylphenylamino)propionitrile
  • 3-(N-Ethylanilino)propionitrile
  • 4-12-00-00891 (Beilstein Handbook Reference)
  • Aniline, N-(2-cyanoethyl)-N-ethyl-
  • Aniline, N-ethyl-N-(2-cyanoethyl)-
  • BRN 0973910
  • EINECS 205-728-4
  • N-(2-Cyanoethyl)-N-ethylaniline
  • N-(Cyanoethyl)-N-ethylaniline
  • N-beta-Cyanoethyl-N-ethylaminobenzene
  • N-Ethyl-N,beta-cyanoethylaniline
  • N-Ethyl-N-(2-cyanoethyl)aniline
  • N-Ethyl-N-2-kyanethylanilin
  • N-Ethyl-N-2-kyanethylanilin [Czech]
  • NSC 81243
  • UNII-465EKH3OG1

Systematic Names

  • 3-(N-Ethylanilino)propiononitrile
  • Aniline, N-ethyl-N-(2-cyanoethyl)-
  • Propanenitrile, 3-(ethylphenylamino)-
  • Propionitrile, 3-(N-ethylanilino)- (6CI,7CI,8CI)

Registry Numbers

CAS Registry Number

  • 148-87-8

FDA UNII

  • 465EKH3OG1

System Generated Number

  • 0000148878

Structure Descriptors

InChI

1S/C11H14N2/c1-2-13(10-6-9-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,10H2,1H3

InChIKey

WYRNRZQRKCXPLA-UHFFFAOYSA-N

Smiles

c1(N(CCC#N)CC)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LC50 inhalation > 400gm/m3 (400000mg/m3)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(1), Pg. 50, 1986.
mouse LD50 oral 1510mg/kg (1510mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(1), Pg. 50, 1986.
rabbit LD50 oral 1510mg/kg (1510mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(1), Pg. 50, 1986.
rat LD50 oral 4840mg/kg (4840mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(9), Pg. 32, 1988.