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vetiveryl propionate

Chemical Structure

General Material Information

Preferred name vetiveryl propionate
Trivial Name 6-Azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, 6-propanoate
Short Description 6-azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, 6-propanoate
Formula C18 H28 O2
CAS Number 10486-26-7
ECHA Number 234-006-1
FDA UNII Search
Nikkaji Number J212.427K
xLogP3-AA 4.00 (est)
NMR Predictor External link
Synonyms
  • 6-azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, 6-propanoate
  • 6-azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, propanoate
  • (4,8-dimethyl-2-propan-2-ylidene-3,3a,4,5,6,8a-hexahydro-1H-azulen-6-yl) propanoate
  • 1,2,3,3a,4,5,6,8a- octahydro-2-isopropylidene-4,8-dimethylazulen-6-yl propionate
  • (4,8-dimethyl-2-propan-2-ylidene-3,3a,4,5,6,8a-hexahydro-1H-azulen-6-yl) propanoate
  • 6-Azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, 6-propanoate
  • 6-Azulenol, 1,2,3,3a,4,5,6,8a-octahydro-2-isopropylidene-4,8-dimethyl-, propionate
  • 6-Azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, propanoate

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.50.3000
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 276.41955566406
Specific gravity @ 25 °C
Pounds per Gallon
Flash Point TCC Value 159.8 °C TCC
logP (o/w) 6.29 est
Solubility
water, 0.07348 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Rooty
rooty, woody, cedar
General comment At 100.00 %. rooty woody cedar

Potential Uses

Applications
Odor purposes Cedarwood, Oriental, Root, Vetiver, Woody

Safety Information

Safety information

Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for vetiveryl propionate flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):10486-26-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :112053
National Institute of Allergy and Infectious Diseases:Data
(4,8-dimethyl-2-propan-2-ylidene-3,3a,4,5,6,8a-hexahydro-1H-azulen-6-yl) propanoate
Chemidplus:0010486267