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Homecas3974-36-5

3974-36-5

3974-36-5 structural image
Product Name: HexylMalonicAcid
Formula: C9H16O4
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COMPUTED DESCRIPTORS

Molecular Weight 188.22 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 188.10485899 g/mol
Monoisotopic Mass 188.10485899 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 163
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

Hexylmalonic acid is a natural product found in Streptomyces toxytricini with data available.