EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

allyl acetoacetate
butanoic acid, 3-oxo-, 2-propenyl ester

Supplier Sponsors

Name:prop-2-enyl 3-oxobutanoate
CAS Number: 1118-84-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:214-269-9
FDA UNII: 8HX066J62P
Nikkaji Web:J101.267C
Beilstein Number:1758569
MDL:MFCD00009811
XlogP3-AA:0.60 (est)
Molecular Weight:142.15430000
Formula:C7 H10 O3
NMR Predictor:Predict (works with chrome, Edge 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
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: -85.00 °C. @ 760.00 mm Hg
Boiling Point: 196.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.501000 mmHg @ 25.00 °C. (est)
Flash Point: 168.00 °F. TCC ( 75.56 °C. )
logP (o/w): 0.703 (est)
Soluble in:
 alcohol
 water, 6.089e+004 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Beijing Lys Chemicals
Allyl acetoacetate
BOC Sciences
For experimental / research use only.
Acetoacetic acid allyl ester 95%
EMD Millipore
For experimental / research use only.
Allyl Acetoacetate
Penta International
ALLYL ACETOACETATE
Santa Cruz Biotechnology
For experimental / research use only.
Allyl Acetoacetate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Allyl acetoacetate 98%
TCI AMERICA
For experimental / research use only.
Allyl Acetoacetate >95.0%(GC)
Tianjin Danjun International
Allyl acetoacetate
 
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
IFRA Purity Specification: < 0.1% free allyl alcohol
Recommendation for allyl acetoacetate usage levels up to:
 not for fragrance use.
 
Recommendation for allyl acetoacetate flavor usage levels up to:
 not for flavor use.
 
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 :70701
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
prop-2-enyl 3-oxobutanoate
Chemidplus:0001118849
 
References:
 prop-2-enyl 3-oxobutanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:1118-84-9
Pubchem (cid):70701
Pubchem (sid):135028748
 
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
Export Tariff Code:2918.30.9000
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 acetoacetic acid allyl ester
 acetoacetic acid, allyl ester
 allyl 3-oxobutanoate
 allyl acetylacetate
 butanoic acid, 3-oxo-, 2-propen-1-yl ester
 butanoic acid, 3-oxo-, 2-propenyl ester
3-oxo-butyric acid allyl ester
 prop-2-enyl 3-oxobutanoate
(2-propenyl) 3-oxobutanoate
 
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2021 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy