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isobutyl (E)-2-butenoate
isobutyl trans-2-butenoate

Sponsors

Name:2-methylpropyl (E)-but-2-enoate
CAS Number: 73545-15-0Picture of molecule3D/inchi
FDA UNII:6H6IW50K3Z
Nikkaji Web:J94.999J
MDL:MFCD00036651
XlogP3-AA:2.30 (est)
Molecular Weight:142.19798000
Formula:C8 H14 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:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"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: 166.40 °C. @ 760.00 mm Hg (est)
Vapor Pressure:1.788000 mm/Hg @ 25.00 °C. (est)
Flash Point: 131.00 °F. TCC ( 55.00 °C. ) (est)
logP (o/w): 2.727 (est)
Soluble in:
 alcohol
 water, 555.2 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium
sweet fruity pineapple apple banana
Odor Description:at 100.00 %. sweet fruity pineapple apple banana
Flavor Type: waxy
">waxy fruity sweet apple pineapple
Taste Description: waxy fruity sweet apple pineapple
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
isoButyl trans-2-butenoate
Sigma-Aldrich
Isobutyl trans-2-butenoate, ≥98%, FCC, FG
Certified Food Grade Products
 
Safety Information:
Preferred SDS: View
 
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: information only not used for fragrances or flavors
Recommendation for isobutyl (E)-2-butenoate usage levels up to:
 not for fragrance use.
 
Recommendation for isobutyl (E)-2-butenoate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):73545-15-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5365793
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
2-methylpropyl (E)-but-2-enoate
Chemidplus:0073545150
 
References:
 2-methylpropyl (E)-but-2-enoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:73545-15-0
Pubchem (cid):5365793
Pubchem (sid):135153572
 
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:
(E)-2-butenoic acid 2-methyl propyl ester
trans-2-butenoic acid 2-methyl propyl ester
2-butenoic acid, 2-methylpropyl ester, (2E)-
2-butenoic acid, 2-methylpropyl ester, (E)-
isobutyl (2E)-2-butenoate
isobutyl (2E)-but-2-enoate
isobutyl (E)-2-crotonate
isobutyl (E)-crotonate
isobutyl trans-2-butenoate
isobutyl trans-2-crotonate
isobutyl trans-crotonate
(E)-crotonic acid isobutyl ester
trans-crotonic acid isobutyl ester
 crotonic acid, isobutyl ester, (trans)-
2-methyl propyl (E)-2-butenoate
2-methyl propyl (E)-crotonate
2-methyl propyl trans-2-butenoate
2-methyl propyl trans-crotonate
2-methylpropyl (E)-but-2-enoate
2-methylpropyl trans-but-2-enoate
 
 
Notes:
None found
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