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962-58-3

962-58-3 structural image
Product Name: DIAZINON-O-ANALOG
Formula: C12H21N2O4P
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1732 1750.6 1758.6 1742 1729.3

COMPUTED DESCRIPTORS

Molecular Weight 288.28 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 288.12389415 g/mol
Monoisotopic Mass 288.12389415 g/mol
Topological Polar Surface Area 70.5 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 304
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

Diazoxon is an organic phosphate that is diethyl hydrogen phosphate in which the hydrogen of the hydroxy group has been replaced by a 6-methyl-2-(propan-2-yl)pyrimidin-4-yl group. It is a metabolite of the pesticide diazinon. It has a role as a marine xenobiotic metabolite. It is an organic phosphate and a member of pyrimidines.