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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, Edge 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
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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 mmHg @ 25.00 °C. (est)
Flash Point: 241.00 °F. TCC ( 116.11 °C. )
logP (o/w): 5.316 (est)
Soluble in:
 water, 0.5625 mg/L @ 25 °C (est)
Insoluble in:
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
BOC Sciences
For experimental / research use only.
isoPropyl Undecylenate
Grau Aromatics
SRS Aromatics
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
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:
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 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
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
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
 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 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
Potential Blenders and core components note
None Found
Potential Uses:
None Found
Occurrence (nature, food, other):note
 not found in nature
 propan-2-yl undec-10-enoate
isopropyl 10-undecenate
isopropyl 10-undecenoate
isopropyl undec-10-enoate
10-undecenoic acid 1-methyl ethyl ester
10-undecenoic acid 1-methylethyl ester
10-undecenoic acid, 1-methylethyl ester
None found
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