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(-)-methyl dihydrojasmonate
methyl trans-dihydrojasmonate

Supplier Sponsors

Name:methyl 2-[(1R,2R)-3-oxo-2-pentylcyclopentyl]acetate
CAS Number: 2630-39-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:220-112-5
FDA UNII:XM1C2C5MMN
Nikkaji Web:J192.149E
XlogP3-AA:2.70 (est)
Molecular Weight:226.31594000
Formula:C13 H22 O3
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
Google Books:Search
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
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PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 307.00 to 308.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 267.00 °F. TCC ( 130.80 °C. ) (est)
logP (o/w): 2.496 (est)
Soluble in:
 alcohol
 water, 91.72 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Cyclopentaneaceticacid, 3-oxo-2-pentyl-, methyl ester, (1R,2R)-
 
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
 
 
Safety References:
EPI System: View
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):2630-39-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :1738124
National Institute of Allergy and Infectious Diseases:Data
methyl 2-[(1R,2R)-3-oxo-2-pentylcyclopentyl]acetate
Chemidplus:0002630399
 
References:
 methyl 2-[(1R,2R)-3-oxo-2-pentylcyclopentyl]acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:2630-39-9
Pubchem (cid):1738124
Pubchem (sid):135057812
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 cyclopentaneacetic acid, 3-oxo-2-pentyl-, methyl ester, (1R,2R)-
trans-dihydrojasmonic acid methyl ester
(E)-(-)-hedione
trans-(-)-hedione
 methyl (1R-trans)-3-oxo-2-pentyl cyclopentane acetate
 methyl (E)-dihydrojasmonate
 methyl [(1R,2R)-3-oxo-2-pentylcyclopentyl]acetate
 methyl 2-[(1R,2R)-3-oxo-2-pentylcyclopentyl]acetate
(1R,2R)-methyl dihydrojasmonate
 methyl trans-dihydrojasmonate
 
 
Notes:
None found
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