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3-Methyl-4-Sulfanyl-2-Pentanone
[CAS# 385766-53-0]

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CAS#: 385766-53-0
Product: 3-Methyl-4-Sulfanyl-2-Pentanone
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Identification
Name 3-Methyl-4-Sulfanyl-2-Pentanone
Synonyms pentan-2-one, 4-mercapto-3-methyl-
Molecular Structure CAS#: 385766-53-0, 3-Methyl-4-Sulfanyl-2-Pentanone
Molecular Formula C6H12OS
Molecular Weight 132.22
CAS Registry Number 385766-53-0
SMILES O=C(C)C(C)C(S)C
InChI 1S/C6H12OS/c1-4(5(2)7)6(3)8/h4,6,8H,1-3H3
InChIKey VPFDUTYZTDYOAS-UHFFFAOYSA-N
Properties
Density 0.948g/cm3 (Cal.)
Boiling point 181.654°C at 760 mmHg (Cal.)
Flash point 63.662°C (Cal.)
Refractive index 1.453 (Cal.)
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