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3-methyl-3-penten-2-one
3-penten-2-one, 3-methyl-

Supplier Sponsors

CAS Number: 565-62-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:209-283-7
FDA UNII:JBR4O01DB2
Nikkaji Web:J24.198I
Beilstein Number:1719967
MDL:MFCD00151839
XlogP3-AA:1.10 (est)
Molecular Weight:98.14490000
Formula:C6 H10 O
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: -70.00 °C. @ 760.00 mm Hg
Boiling Point: 137.00 to 139.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:6.866000 mm/Hg @ 25.00 °C. (est)
Flash Point: 93.00 °F. TCC ( 34.00 °C. )
logP (o/w): 1.069 (est)
Soluble in:
 alcohol
 water, 29.1 g/L @ 20 °C (exp)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Description:sweaty
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
BOC Sciences
For experimental / research use only.
3-Methyl-3-penten-2-one
EMD Millipore
For experimental / research use only.
3-Methyl-3-penten-2-one
Godavari Biorefineries
3-Methyl-3-penten-2-one
Santa Cruz Biotechnology
For experimental / research use only.
3-Methyl-3-penten-2-one
Sigma-Aldrich: Aldrich
For experimental / research use only.
3-Methyl-3-penten-2-one technical, ≥90% (GC)
TCI AMERICA
For experimental / research use only.
3-Methyl-3-penten-2-one >95.0%(GC)
 
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: fragrance agents
 
Recommendation for 3-methyl-3-penten-2-one flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):565-62-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5364579
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1224
WGK Germany:3
(E)-3-methylpent-3-en-2-one
Chemidplus:0000565628
 
References:
 (E)-3-methylpent-3-en-2-one
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:565-62-8
Pubchem (cid):5364579
Pubchem (sid):135036452
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2914.19.0000
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2-acetyl-2-butene
3-methyl pent-3-en-2-one
3-methyl-3-penten-2-ol
3-methyl-3-penten-2-one
3-methyl-3-pentene-2-one
(E)-3-methylpent-3-en-2-one
3-methylpent-3-en-2-one
3-penten-2-one, 3-methyl-
 
 
Notes:
None found
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