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Substance Name: 4-Cyano-N,N-dimethylaniline
RN: 1197-19-9
UNII: 8391XON0MF
InChIKey: JYMNQRQQBJIMCV-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-N2

Molecular Weight

  • 146.192
 
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Names and Synonyms

Name of Substance

  • 4-Cyano-N,N-dimethylaniline

Synonyms

  • 4-(Dimethylamino)benzenecarbonitrile
  • 4-(Dimethylamino)benzonitrile
  • EINECS 214-819-8
  • N,N-Dimethyl-4-cyanoaniline
  • N,N-Dimethyl-p-cyanoaniline
  • NSC 409122
  • p-(Dimethylamino)benzoic acid nitrile
  • p-(N,N-Dimethylamino)benzonitrile
  • p-Cyano-N,N-dimethylaniline
  • p-Dimethylaminobenzonitrile
  • Para(dimethylamino)benzonitrile
  • UNII-8391XON0MF

Systematic Names

  • 4-(Dimethylamino)benzonitrile
  • Benzonitrile, 4-(dimethylamino)-
  • Benzonitrile, 4-(dimethylamino)- (9CI)
  • Benzonitrile, p-(dimethylamino)- (8CI)

Registry Numbers

CAS Registry Number

  • 1197-19-9

FDA UNII

  • 8391XON0MF

System Generated Number

  • 0001197199

Structure Descriptors

InChI

1S/C9H10N2/c1-11(2)9-5-3-8(7-10)4-6-9/h3-6H,1-2H3

InChIKey

JYMNQRQQBJIMCV-UHFFFAOYSA-N

Smiles

CN(C)c1ccc(C#N)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 74 deg C   EXP
Boiling Point 318 deg C   EXP
pKa Dissociation Constant 1.777 (none) 25 EXP
log P (octanol-water) 2.2 (none)   EXP
Water Solubility 566 mg/L 25 EST
Vapor Pressure 0.021 mm Hg 25 EST
Henry's Law Constant 8.28E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.78E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.