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linalool oxide acetates

Chemical Structure

General Material Information

Preferred name linalool oxide acetates
Trivial Name 2-Furanmethanol, 5-ethenyltetrahydro-α,α,5-trimethyl-, 2-acetate
Short Description 2-furanmethanol, 5-ethenyltetrahydro-a,a,5-trimethyl-, acetate
Formula C12 H20 O3
CAS Number 67689-50-3
ECHA Number 266-907-0
FDA UNII Search
Nikkaji Number J333.309D
xLogP3-AA 2.00 (est)
NMR Predictor External link
Synonyms
  • 5-(1-acetoxy-1-methyl ethyl)-2-methyl-2-vinyl tetrahydrofuran
  • 5-(1-acetoxy-1-methylethyl)-2-methyl-2-vinyltetrahydrofuran
  • 2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-yl acetate
  • 2-furanmethanol, 5-ethenyltetrahydro-a,a,5-trimethyl-, acetate
  • 2-methyl-2-vinyl-5-(acetoxyisopropyl) tetrahydrofuran
  • 2-methyl-2-vinyl-5-(acetoxyisopropyl)tetrahydrofuran
  • tetrahydro-a,a,5-trimethyl-5-vinylfurfuryl acetate
  • tetrahydro-alpha,alpha,5-trimethyl-5-vinyl furfuryl acetate
  • 2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-yl acetate
  • 2-Furanmethanol, 5-ethenyltetrahydro-α,α,5-trimethyl-, 2-acetate
  • 2-Furanmethanol, 5-ethenyltetrahydro-α,α,5-trimethyl-, 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:2915.39.9050
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
EFSA Update of results on the monitoring of furan levels in food:Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:Read Report

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 212.28900146484
Boiling Point 251 to 252°C @ 760 mm Hg
Vapor Pressure 0.021 mmHg @ 25 °C
Flash Point TCC Value 103.89 °C TCC
logP (o/w) 2.431 est
Solubility
alcohol Yes
water, 105.3 mg/L @ 25 °C (est) Yes
water No
Stability
fairly stable in all media Unspecified

Organoleptic Properties

Odor Type: Fruity
warm, fruity, woody
General comment At 100.00 %. warm fruity woody

Occurrences

Potential Uses

Applications
Odor purposes Berry , Currant black currant , Fruit , 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:
flavor and 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 linalool oxide acetates usage levels up to:
6.0000 % in the fragrance concentrate.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):67689-50-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :106770
National Institute of Allergy and Infectious Diseases:Data
2-(5-ethenyl-5-methyloxolan-2-yl)propan-2-yl acetate
Chemidplus:0067689503