2-methyl butyl angelate
2-butenoic acid, 2-methyl-, 2-methylbutyl ester, (2Z)-
 
Notes:
None found
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CAS Number: 61692-77-1Picture of molecule3D/inchi
FDA UNII: Search
Nikkaji Web: J213.411J
XlogP3-AA: 3.00 (est)
Molecular Weight: 170.25186000
Formula: C10 H18 O2
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 209.17 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.206000 mmHg @ 25.00 °C. (est)
Flash Point: 168.00 °F. TCC ( 75.40 °C. ) (est)
logP (o/w): 3.810 (est)
Soluble in:
 alcohol
 water, 53.9 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: floral
 
 floral  fruity  
Odor Description:
at 100.00 %. 
floral fruity
 
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: natural substances and extractives
Recommendation for 2-methyl butyl angelate usage levels up to:
 not for fragrance use.
 
Recommendation for 2-methyl butyl angelate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
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EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6427119
National Institute of Allergy and Infectious Diseases: Data
 2-methylbutyl (Z)-2-methylbut-2-enoate
Chemidplus: 0061692771
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References:
 2-methylbutyl (Z)-2-methylbut-2-enoate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 6427119
Pubchem (sid): 135193678
Pherobase: View
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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
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
 found in nature
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Synonyms:
2-butenoic acid, 2-methyl-, 2-methylbutyl ester, (2Z)-
2-methylbutyl (2Z)-2-methylbut-2-enoate
2-methylbutyl (Z)-2-methylbut-2-enoate
2-methylbutyl 2-methyl-2-butenoate (Z)-
2-methylbutyl 2-methylisocrotonate
2-methylbutyl angelate
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