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13980-04-6

13980-04-6 structural image
Product Name: hexahydro-1,3,5-trinitroso-1,3,5-triazine
Formula: C3H6N6O3
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COMPUTED DESCRIPTORS

Molecular Weight 174.12 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 0
Exact Mass 174.05013807 g/mol
Monoisotopic Mass 174.05013807 g/mol
Topological Polar Surface Area 98 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 151
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

1,3,5-trinitroso-1,3,5-triazinane is a member of 1,3,5-triazinanes and a nitrosamine.