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23838-19-9

23838-19-9 structural image
Product Name: Disulfide, methyl (1E)-1-propen-1-yl
Formula: C4H8S2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description colourless liquid
Density 0.955-0.961
Refractive Index 1.5415-1.5515
Kovats Retention Index 1104 1110 919 915.5 918 922 922

COMPUTED DESCRIPTORS

Molecular Weight 120.2 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 120.00674260 g/mol
Monoisotopic Mass 120.00674260 g/mol
Topological Polar Surface Area 50.6 Ų
Heavy Atom Count 6
Formal Charge 0
Complexity 40.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methyl propenyl disulfide is a natural product found in Allium cepa and Allium sativum with data available.