3-methyl-3-buten-2-one

3-butene-2-one, 3-methyl

CAS: 814-78-8 C5 H8 O MW: 84.11796000

Identification

Name3-methyl-3-buten-2-one
IUPAC3-methylbut-3-en-2-one
CAS Number814-78-8
EINECS212-405-1
FDA UNIIF64867GQVB
Molecular FormulaC5 H8 O
Molecular Weight84.11796000
MDL NumberMFCD00059207
Nikkaji NumberJ35.118K
Beilstein1071241

Regulatory

FDA Mainterm (SATF)814-78-8 ; 3-METHYL-3-BUTEN-2-ONE

Physical Properties

Appearance colorless clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Melting Point -54.00 °C. @ 760.00 mm Hg
Boiling Point 97.00 to 99.00 °C. @ 760.00 mm Hg
Vapor Pressure 40.722000 mmHg @ 25.00 °C. (est)
Flash Point 51.00 °F. TCC ( 10.56 °C. )
logP (o/w) 0.561 (est)
Shelf Life 6.00 month(s) or longer if stored properly.
Storage refrigerate in tightly sealed containers.
Soluble in alcohol
Insoluble in water

No sensory data available

Safety Information

Preferred SDSView
Oral/Parenteral Toxicityoral-rat LD50 180 mg/kg
Dermal Toxicityskin-rabbit LD50 230 ul/kg
Inhalation Toxicityinhalation-guinea pig LCLo 250 ppm/4H

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categorynatural substances and extractives
Recommendation for 3-methyl-3-buten-2-one usage levels up tonot for fragrance use.
Recommendation for 3-methyl-3-buten-2-one flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

ginger lily white ginger lily hedychium gardnerianum

Synonyms

3- buten-2-one, 3-methyl- 3- butene-2-one, 3-methyl ketone, methyl isopropenyl 3- methyl but-3-en-2-one methyl isopropenyl ketone 2- methyl-1-buten-3-one 2- methyl-1-butene-3-one 3- methyl-3-butene-2-one 3- methylbut-3-en-2-one 3- methylene-2-butanone propen-2-yl methyl ketone iso propenyl methyl ketone Try the PubMed Search.