isobutyl senecioate
3-methyl-2-butenoic acid, 2-methylpropyl ester
 
Notes:
None found
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CAS Number: 30434-54-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 250-197-4
Nikkaji Web: J249.990H
XlogP3-AA: 2.90 (est)
Molecular Weight: 156.22492000
Formula: C9 H16 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: information only not used for fragrances or flavors
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 187.00 to  188.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.617000 mmHg @ 25.00 °C. (est)
Flash Point: 150.00 °F. TCC ( 65.50 °C. ) (est)
logP (o/w): 3.088 (est)
Soluble in:
 alcohol
 water, 164.4 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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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
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Safety in Use Information:
Category: information only not used for fragrances or flavors
Recommendation for isobutyl senecioate usage levels up to:
 not for fragrance use.
 
Recommendation for isobutyl senecioate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 121709
National Institute of Allergy and Infectious Diseases: Data
 2-methylpropyl 3-methylbut-2-enoate
Chemidplus: 0030434549
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References:
 2-methylpropyl 3-methylbut-2-enoate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 121709
Pubchem (sid): 135142927
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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
Typical G.C.
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 heracleum paphlagonicum czeczott fruit oil turkey @ <0.10%
Data  GC  Search Trop  Picture
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Synonyms:
2-butenoic acid, 3-methyl-, 2-methylpropyl ester
isobutyl 3-methyl-2-butenoate
isobutyl 3-methylbut-2-enoate
3-methyl-2-butenoic acid 2-methylpropyl ester
3-methyl-2-butenoic acid, 2-methylpropyl ester
2-methylpropyl 3-methylbut-2-enoate
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