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Substance Name: beta-Cadinene
RN: 523-47-7
UNII: Z07LA0GY4J
InChIKey: USDOQCCMRDNVAH-KKUMJFAQSA-N

Molecular Formula

  • C15-H24

Molecular Weight

  • 204.355
 
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Names and Synonyms

Name of Substance

  • beta-Cadinene

Synonyms

  • beta-Cadinene
  • beta-Cadinene, (-)-
  • Cadina-3,9-diene
  • Cadine-3,9-diene
  • CCRIS 5894
  • HSDB 4355
  • Naphthalene, 1,2,4a,5,8,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-(1alpha,4abeta,8aalpha))-
  • NCI-C56008
  • NSC 46152
  • UNII-Z07LA0GY4J

Systematic Names

  • beta-Cadinene
  • Cadina-3,9-diene (8CI)
  • Naphthalene, 1,2,4a,5,8,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S,4aR,8aS)-
  • Naphthalene, 1,2,4a,5,8,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-(1alpha,4abeta,8aalpha))- (9CI)

Registry Numbers

CAS Registry Number

  • 523-47-7

FDA UNII

  • Z07LA0GY4J

System Generated Number

  • 0000523477

Structure Descriptors

InChI

1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5-6,10,13-15H,7-9H2,1-4H3/t13-,14-,15-/m0/s1

InChIKey

USDOQCCMRDNVAH-KKUMJFAQSA-N

Smiles

C1[C@@H]2[C@H](C(=CC[C@H]2C(C)C)C)CC=C1C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 274 deg C   EXP
log P (octanol-water) 6.640 (none)   EST
Atmospheric OH Rate Constant 1.88E-10 cm3/molecule-sec 25 EST

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