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Substance Name: Bisabolene
RN: 495-62-5
UNII: E6941S3U3Q
InChIKey: XBGUIVFBMBVUEG-CCEZHUSRSA-N

Molecular Formula

  • C15-H24

Molecular Weight

  • 204.355
 
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Names and Synonyms

Results Name

  • Bisabolene

Name of Substance

  • gamma-Bisabolene

Synonyms

  • 1-Methyl-4-(1,5-dimethyl-4-hexenylidene)-1-cyclohexene
  • 2-Heptene, 2-methyl-6-(4-methyl-3-cyclohexen-1-ylidene)-
  • 2-Methyl-6-(4-methyl-3-cyclohexen-1-ylidene)-2-heptene
  • 4-(1,5-Dimethyl-4-hexenylidene)-1-methylcyclohexene
  • Bisabolene (6CI)
  • Bisabolene (natural)
  • Cyclohexene, 4-(1,5-dimethyl-4-hexenylidene)-1-methyl-
  • EINECS 207-805-8
  • FEMA No. 3331
  • Limene
  • UNII-E6941S3U3Q

Systematic Names

  • 2-Heptene, 2-methyl-6-(4-methyl-3-cyclohexen-1-ylidene)- (7CI,8CI)
  • 6-Methyl-2-(4-methylcyclohex-3-enyl)hept-1,5-diene
  • Cyclohexene, 4-(1,5-dimethyl-4-hexen-1-ylidene)-1-methyl-
  • Cyclohexene, 4-(1,5-dimethyl-4-hexenylidene)-1-methyl-

Superlist Name

  • Bisabolene

Registry Numbers

CAS Registry Number

  • 495-62-5

FDA UNII

  • E6941S3U3Q

Other Registry Number

  • 11003-31-9

System Generated Number

  • 0000495625

Structure Descriptors

InChI

1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8H,5,7,9-11H2,1-4H3/b15-14+

InChIKey

XBGUIVFBMBVUEG-CCEZHUSRSA-N

Smiles

C1(=C(\CC\C=C(\C)C)C)\CCC(C)=CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 725, 1975.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 725, 1975.