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laevo-linalyl acetate
1,6-octadien-3-ol, 3,7-dimethyl-, acetate, (3R)-

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Name:[(3R)-3,7-dimethylocta-1,6-dien-3-yl] acetate
CAS Number: 16509-46-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:240-575-7
FDA UNII:J7C5I8LV3G
Nikkaji Web:J63.971K
XlogP3-AA:3.30 (est)
Molecular Weight:196.28980000
Formula:C12 H20 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 218.00 to 219.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.116000 mmHg @ 25.00 °C. (est)
Flash Point: 157.00 °F. TCC ( 69.44 °C. )
logP (o/w): 3.907 (est)
Soluble in:
 alcohol
 water, 20.12 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: green
green
Odor Description:green
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
(R)-Linalyl Acetate
 
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
 
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):16509-46-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :442474
National Institute of Allergy and Infectious Diseases:Data
[(3R)-3,7-dimethylocta-1,6-dien-3-yl] acetate
Chemidplus:0016509469
 
References:
 [(3R)-3,7-dimethylocta-1,6-dien-3-yl] acetate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):442474
Pubchem (sid):135043421
 
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
KEGG (GenomeNet):C09863
HMDB (The Human Metabolome Database):Search
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
(3R)-3,7-dimethyl-1,6-octadien-3-ol acetate
(3R)-3,7-dimethylocta-1,6-dien-3-yl acetate
[(3R)-3,7-dimethylocta-1,6-dien-3-yl] acetate
(R)-linalyl acetate
L-linalyl acetate
1,6-octadien-3-ol, 3,7-dimethyl-, acetate, (3R)-
 
 
Notes:
None found
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