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Substance Name: Carotol
RN: 465-28-1
UNII: NT5C9M36DE
InChIKey: XZYQCFABZDVOPN-ILXRZTDVSA-N

Molecular Formula

  • C15-H26-O

Molecular Weight

  • 222.3694
 
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Names and Synonyms

Name of Substance

  • Carotol

Synonyms

  • (+)-Carotol
  • 3aalpha(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-3alpha-isopropyl-6,8aalpha-dimethyl-, (+)-
  • UNII-NT5C9M36DE

Systematic Name

  • 3a(1H)-Azulenol, 2,3,4,5,8,8a-hexahydro-6,8a-dimethyl-3-(1-methylethyl)-, (3R-(3alpha,3aalpha,8aalpha))-

Registry Numbers

CAS Registry Number

  • 465-28-1

FDA UNII

  • NT5C9M36DE

System Generated Number

  • 0000465281

Structure Descriptors

InChI

1S/C15H26O/c1-11(2)13-7-9-14(4)8-5-12(3)6-10-15(13,14)16/h5,11,13,16H,6-10H2,1-4H3/t13-,14+,15+/m1/s1

InChIKey

XZYQCFABZDVOPN-ILXRZTDVSA-N

Smiles

CC(C)[C@H]1CC[C@]2(C)CC=C(C)CC[C@]12O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point < 25 deg C   EXP
log P (octanol-water) 4.810 (none)   EST
Atmospheric OH Rate Constant 1.06E-10 cm3/molecule-sec 25 EST

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