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isopropyl undecylenate
10-undecenoic acid, 1-methylethyl ester

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Name:propan-2-yl undec-10-enoate
CAS Number: 5459-98-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:226-735-9
Nikkaji Web:J210.521G
XlogP3:5.00 (est)
Molecular Weight:226.35962000
Formula:C14 H26 O2
BioActivity Summary:listing
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
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 274.00 to 276.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.004000 mm/Hg @ 25.00 °C. (est)
Flash Point: 241.00 °F. TCC ( 116.11 °C. )
logP (o/w): 5.316 (est)
Soluble in:
 alcohol
 water, 0.5625 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl undecylenate
amyl undecylenate
isoamyl undecylenate
butyl undecylenate
isobutyl undecylenate
para-cresyl 10-undecylenate
ethyl undecylenate
geranyl undecylenate
heptyl undecylenate
methyl undecylenate
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
isoPropyl Undecylenate
Grau Aromatics
iso-PROPYL-UNDECYLENATE
SRS Aromatics
isoPROPYL UNDECYLENATE
 
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 isopropyl undecylenate usage levels up to:
  6.0000 % in the fragrance concentrate.
 
Recommendation for isopropyl undecylenate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):5459-98-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :79578
National Institute of Allergy and Infectious Diseases:Data
propan-2-yl undec-10-enoate
Chemidplus:0005459983
 
References:
 propan-2-yl undec-10-enoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):79578
Pubchem (sid):135037892
 
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
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 propan-2-yl undec-10-enoate
isopropyl 10-undecenate
isopropyl 10-undecenoate
isopropyl undec-10-enoate
iso-propyl-undecylenate
10-undecenoic acid 1-methyl ethyl ester
10-undecenoic acid 1-methylethyl ester
10-undecenoic acid, 1-methylethyl ester
 

Articles:

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Notes:
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