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61122-71-2

61122-71-2 structural image
Product Name: S-METHYL 4-METHYLPENTANETHIOATE
Formula: C7H14OS
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description colourless to pale yellow liquid
Boiling Point 110.00 to 112.00 °C. @ 20.00 mm Hg
Solubility soluble in oil and alcohol
Density 0.832-0.837
Refractive Index 1.472-1.478
Kovats Retention Index 1355

COMPUTED DESCRIPTORS

Molecular Weight 146.25 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 146.07653624 g/mol
Monoisotopic Mass 146.07653624 g/mol
Topological Polar Surface Area 42.4 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 88.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

S-Methyl 4-methylpentanethioate is a thioester.