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    General Material Information
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sclarene

Chemical Structure

General Material Information

Preferred name sclarene
Trivial Name Sclarene
Short Description naphthalene, decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)-, (4aS,5S,8aS)-
Formula C20 H32
CAS Number 511-02-4
FDA UNII 95E3AV9Y7E
Nikkaji Number J82.294I
xLogP3-AA 7.50 (est)
NMR Predictor External link
Synonyms
  • 4,5-decamethylene oxazole
  • labda-8(17),13(16),14-triene
  • labda-8(20),13(16),14-triene
  • naphthalene, decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)-, (4aS,5S,8aS)-
  • (+)- sclarene
  • (4aS,5S,8aS)-1,1,4a- trimethyl-6-methylene-5-(3-methylene pent-4-enyl) decalin
  • (4aS,5S,8aS)-1,1,4a- trimethyl-6-methylene-5-(3-methylenepent-4-en-1-yl)decahydronaphthalene
  • (4aS,5S,8aS)-1,1,4a- trimethyl-6-methylidene-5-(3-methylidenepent-4-en-1-yl)decahydronaphthalene
  • (4aS,8S,8aS)-4,4,8a- trimethyl-7-methylidene-8-(3-methylidenepent-4-enyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene
  • (4aS,8S,8aS)-4,4,8a-trimethyl-7-methylidene-8-(3-methylidenepent-4-enyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene
  • Naphthalene, decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-pentenyl)-, [4aS-(4aα,5α,8aβ)]-
  • Naphthalene, decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-pentenyl)-, (4aS,5S,8aS)-
  • (4aS,5S,8aS)-Decahydro-1,1,4a-trimethyl-6-methylene-5-(3-methylene-4-penten-1-yl)naphthalene
  • Sclaren
  • Iso-biformene

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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
CHEBI:View
HMDB (The Human Metabolome Database):Search
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 272.47503662109
Boiling Point 337 to 338°C @ 760 mm Hg
Vapor Pressure 0.000201 mmHg @ 25 °C
Flash Point TCC Value 151.67 °C TCC
logP (o/w) 8.712 est
Solubility
water, 0.0002378 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Woody
green, terpenic, woody, amber, sage clary sage
General comment At 1.00 % in dipropylene glycol. powerful green terpenic woody amber clary sage

Occurrences

Potential Uses

Applications
Odor purposes Amber , Clary sage oil replacer , 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:
natural substances and extractives
Recommendation for sclarene usage levels up to:
not for fragrance use.
Recommendation for sclarene flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :11323257
National Institute of Allergy and Infectious Diseases:Data
(4aS,8S,8aS)-4,4,8a-trimethyl-7-methylidene-8-(3-methylidenepent-4-enyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene
Chemidplus:0000511024