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Substance Name: 3,7-Dimethyl-2,6-nonadienenitrile
RN: 61792-11-8
UNII: B8MK5EZU56
InChIKey: DHJVLXVXNFUSMU-CPFHMWAYSA-N

Molecular Formula

  • C11-H17-N

Molecular Weight

  • 163.262
 
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Names and Synonyms

Name of Substance

  • 3,7-Dimethyl-2,6-nonadienenitrile

Synonyms

  • 3,7-Dimethyl-2,6-nonadienenitrile
  • EC 263-214-5
  • EINECS 263-214-5
  • Lemonile
  • UNII-B8MK5EZU56

Systematic Names

  • 2,6-Nonadienenitrile, 3,7-dimethyl-
  • 3,7-Dimethylnona-2,6-dienenitrile

Registry Numbers

CAS Registry Number

  • 61792-11-8

FDA UNII

  • B8MK5EZU56

System Generated Number

  • 0061792118

Structure Descriptors

InChI

InChI=1S/C11H17N/c1-4-10(2)6-5-7-11(3)8-9-12/h6,8H,4-5,7H2,1-3H3/b10-6?,11-8-

InChIKey

DHJVLXVXNFUSMU-CPFHMWAYSA-N

Smiles

CC\C(=C\CC\C(=C\C#N)\C)\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 27S, 1992.
rat LD50 oral 2600mg/kg (2600mg/kg)   Food and Chemical Toxicology. Vol. 30, Pg. 27S, 1992.