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Substance Name: alpha-Santalol
RN: 115-71-9
UNII: 15X09F2755
InChIKey: PDEQKAVEYSOLJX-RQGDDBKYSA-N

Classification Codes

  • Natural Product
  • Skin / Eye Irritant

Molecular Formula

  • C15-H24-O

Molecular Weight

  • 220.3536
 
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Names and Synonyms

Name of Substance

  • alpha-Santalol

Synonyms

  • (Z)-alpha-Santalol
  • 2-Penten-1-ol, 5-(2,3-dimethyltricyclo(2.2.1.0(2,6))hept-3-yl)-2-m
  • 2-Penten-1-ol, 5-(2,3-dimethyltricyclo(2.2.1.0(sup 2,6))hept-3-yl)-2-methyl
  • 2-Penten-1-ol, 5-(2,3-dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methyl-, stereoisomer
  • 5-(2,3-Dimethyltricyclo(2.2.1.0(2,6))hept-3-yl)-2-methyl-2-penten-1-ol
  • 5-(2,3-Dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methyl-2-penten-1-ol stereoisomer
  • alpha-Santalol
  • Argeol
  • Arheol
  • cis-alpha-Santalol
  • d-alpha-Santalol
  • EINECS 204-102-8
  • HSDB 3421
  • Sandal
  • Santalol A
  • UNII-15X09F2755

Systematic Names

  • 2-Penten-1-ol, 5-((1R,3R,6S)-2,3-dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methyl-, (2Z)-
  • 2-Penten-1-ol, 5-(2,3-dimethyltricyclo(2.2.1.0(sup 2,6))hept-3-yl)-2-methyl-, (R(Z))-
  • 5-(2,3-Dimethyltricyclo(2.2.1.02,6)hept-3-yl)-2-methylpent-2-en-1-ol, stereoisomer

Superlist Name

  • Santalol, alpha-

Registry Numbers

CAS Registry Number

  • 115-71-9

FDA UNII

  • 15X09F2755

Other Registry Numbers

  • 14490-13-2
  • 29887-36-3

System Generated Number

  • 0000115719

Structure Descriptors

InChI

1S/C15H24O/c1-10(9-16)5-4-6-14(2)11-7-12-13(8-11)15(12,14)3/h5,11-13,16H,4,6-9H2,1-3H3/b10-5-/t11?,12-,13+,14-,15?/m1/s1

InChIKey

PDEQKAVEYSOLJX-RQGDDBKYSA-N

Smiles

C\C(=C\CC[C@]1(C)C2C[C@@H]3[C@H](C2)C13C)\CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 991, 1974.
rat LD50 oral 3800mg/kg (3800mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 991, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 301.5 deg C   EXP
log P (octanol-water) 4.960 (none)   EST
Atmospheric OH Rate Constant 9.55E-11 cm3/molecule-sec 25 EST

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