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beta,2,2,3-tetramethyl-delta-methylene-3-cyclopentene-1-butanol

Chemical Structure

General Material Information

Preferred name beta,2,2,3-tetramethyl-delta-methylene-3-cyclopentene-1-butanol
Trivial Name β,2,2,3-Tetramethyl-δ-methylene-3-cyclopentene-1-butanol
Short Description firsantol (Firmenich)
Formula C14 H24 O
CAS Number 104864-90-6
FDA UNII Search
Nikkaji Number J2.470.888H
xLogP3-AA 3.70 (est)
NMR Predictor External link
Synonyms
  • 3-cyclopentene-1-butanol, b,2,2,3-tetramethyl-d-methylene-
  • 3-cyclopentene-1-butanol, beta,2,2,3-tetramethyl-delta-methylene-
  • firsantol (Firmenich)
  • 2-methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-1-ol
  • 2-methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-1-ol
  • 3-Cyclopentene-1-butanol, β,2,2,3-tetramethyl-δ-methylene-
  • β,2,2,3-Tetramethyl-δ-methylene-3-cyclopentene-1-butanol

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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
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 208.34448242188
Flash Point TCC Value 108.1 °C TCC
logP (o/w) 4.43
Solubility
alcohol Yes
water, 5.204 mg/L @ 25 °C (est) Yes
Stability
APC: 0.1 - 1% Unspecified
candle: 0.1 - 5% Unspecified
detergent: 0.1 - 5% Unspecified
fine fragrances: 0.1 - 5% Unspecified
shampoo: 0.1 - 1% Unspecified
shower gel: 0.1 - 1% Unspecified
soap: 0.1 - 1% Unspecified
softener: 0.1 - 5% Unspecified

Organoleptic Properties

Odor Type: Woody
natural, sandalwood
Odor strength high , recommend smelling in a 10.00 % solution or less
Substantivity 336 hour(s) at 100.00 %
General comment At 10.00 % in dipropylene glycol. natural sandalwood
FIRSANTOL™ can be used in any type of fragrances to give a powerful sandalwood touch. Tenacity is improved with a very natural sandalwood aspect. Very powerful and natural sandalwood note

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 beta,2,2,3-tetramethyl-delta-methylene-3-cyclopentene-1-butanol 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):104864-90-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :16063533
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-1-ol
Chemidplus:0104864906