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1679-47-6

1679-47-6 structural image
Product Name: ALPHA-METHYL-GAMMA-BUTYROLACTONE
Formula: C5H8O2
Synonyms: 4,5-Dihydro-3-methyl-2(3H)-furanone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Clear light yellow liquid; [Sigma-Aldrich MSDS]
Kovats Retention Index 941 941
Chemical Classes Other Classes -> Lactones

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P370+P378:In case of fire: Use … for extinction.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 100.12 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 100.052429494 g/mol
Monoisotopic Mass 100.052429494 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 88.1
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dihydro-3-methyl-2(3H)-furanone is a gamma-lactone.