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33049-93-3

33049-93-3 structural image
Product Name: 3-METHYL-2-BUTEN-1-YL THIOLACETATE
Formula: C7H12OS
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description clear colourless liquid
Boiling Point 67.00 to 68.00 °C. @ 760.00 mm Hg
Solubility insoluble in water; soluble in ethanol, triacetin and heptane
Density 0.964-0.969
Refractive Index 1.492-1.497

COMPUTED DESCRIPTORS

Molecular Weight 144.24 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 144.06088618 g/mol
Monoisotopic Mass 144.06088618 g/mol
Topological Polar Surface Area 42.4 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 123
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-(3-Methyl-2-butenyl) ethanethioate is a thiocarboxylic ester.