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68084-03-7

68084-03-7 structural image
Product Name: DI-ISOAMYLTHIOMALATE
Formula: C14H26O4S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless to yellow liquid; Fruity, onion odour
Solubility Practically insoluble or insoluble in water
Density 1.006-1.013
Refractive Index 1.453-1.459

COMPUTED DESCRIPTORS

Molecular Weight 290.42 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 11
Exact Mass 290.15518048 g/mol
Monoisotopic Mass 290.15518048 g/mol
Topological Polar Surface Area 53.6 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 277
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Diisopentyl thiomalate is a fatty acid ester.