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2-hexenyl cyclopentanyl acetate

Chemical Structure

General Material Information

Preferred name 2-hexenyl cyclopentanyl acetate
Trivial Name Cyclopentanol, 2-(2-hexen-1-yl)-, 1-acetate
Short Description jasmonyl acetate
Formula C13 H22 O2
CAS Number 149982-46-7
FDA UNII Search
xLogP3-AA 4.10 (est)
NMR Predictor External link
Synonyms
  • cyclopentanol, 2-(2-hexen-1-yl)-, 1-acetate
  • cyclopentanol, 2-(2-hexenyl)-, acetate
  • [(E)- hex-2-enyl] 2-cyclopentylacetate
  • 2-hexen-1-yl cyclopentanyl acetate
  • 2-hexenyl cyclopentanylacetate
  • 2-(2-hexenyl) cyclopentanol acetate
  • jasmonyl acetate
  • [(E)-hex-2-enyl] 2-cyclopentylacetate
  • 2-(2-Hexenyl)-cyclopentanol acetate

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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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:2915.39.9500
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 210.31674194336
Specific gravity @ 25 °C
Pounds per Gallon 7.655 to 7.739
Refractive Index 1.45 to 1.6 @ 20 °C
Boiling Point 284 to 285°C @ 760 mm Hg
Vapor Pressure 0.003 mmHg @ 25 °C
Flash Point TCC Value 93.33 °C TCC
logP (o/w) 4.572 est
Solubility
alcohol Yes
water, 2.615 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Fruity
fruity, jasmin, pear, lactonic
General comment At 100.00 %. fruity jasmin pear lactone
For fruity notes in jasmine fragrances. A jasmine, somewhat pear-like odor

Potential Uses

Applications
Odor purposes Floral, Fruit, Jasmin

Safety Information

Safety information

European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 36 - Wear suitable protective clothing.
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 2-hexenyl cyclopentanyl acetate usage levels up to:
4.0000 % in the fragrance concentrate.
Recommendation for 2-hexenyl cyclopentanyl acetate 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):149982-46-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6366719
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
[(E)-hex-2-enyl] 2-cyclopentylacetate
Chemidplus:0149982467