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2445-67-2

2445-67-2 structural image
Product Name: ISO-BUTYL-2-METHYLBUTYRATE
Formula: C9H18O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 991 995 985 986 988 991 986 994

COMPUTED DESCRIPTORS

Molecular Weight 158.24 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 158.130679813 g/mol
Monoisotopic Mass 158.130679813 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 119
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

2-Methylpropyl 2-methylbutanoate is a fatty acid ester.