EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

citronellyl crotonate
2-butenoic acid 3,7-dimethyl-6-octenyl ester

Supplier Sponsors

Name:3,7-dimethyloct-6-enyl but-2-enoate
CAS Number: 68039-38-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:268-254-7
Nikkaji Web:J65.663A
XlogP3-AA:4.60 (est)
Molecular Weight:224.34368000
Formula:C14 H24 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 287.00 to 289.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.001000 mm/Hg @ 25.00 °C. (est)
Flash Point: 273.00 °F. TCC ( 133.89 °C. )
logP (o/w): 5.417 (est)
Soluble in:
 alcohol
 water, 0.9197 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Grau Aromatics
CITRONELLYL-CROTONATE
SRS Aromatics
CIRTONELLYL CROTONATE
 
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
Recommendation for citronellyl crotonate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Recommendation for citronellyl crotonate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):68039-38-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5365882
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3,7-dimethyloct-6-enyl but-2-enoate
Chemidplus:0068039383
 
References:
 3,7-dimethyloct-6-enyl but-2-enoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:68039-38-3
Pubchem (cid):5365882
Pubchem (sid):135009947
 
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
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
2-butenoic acid 3,7-dimethyl-6-octen-1-yl ester
2-butenoic acid 3,7-dimethyl-6-octenyl ester
2-butenoic acid, 3,7-dimethyl-6-octen-1-yl ester
 citronellyl but-2-enoate
 citronellyl-crotonate
3,7-dimethyl-6-octenyl 2-butenoate
3,7-dimethyloct-6-en-1-yl but-2-enoate
3,7-dimethyloct-6-enyl but-2-enoate
 
 
Notes:
None found
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