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40136-65-0

40136-65-0 structural image
Product Name: isopropyl methyl disulphide
Formula: C4H10S2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 906 906 899

COMPUTED DESCRIPTORS

Molecular Weight 122.3 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 122.02239267 g/mol
Monoisotopic Mass 122.02239267 g/mol
Topological Polar Surface Area 50.6 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 26.7
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

2-(Methyldisulfanyl)propane is a natural product found in Solanum tuberosum with data available.