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85352-99-4

85352-99-4 structural image
Product Name: 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL-N-OXIDE)-1-BUTANOL
Formula: C10H15N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 225.24 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 225.11134135 g/mol
Monoisotopic Mass 225.11134135 g/mol
Topological Polar Surface Area 78.4 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 216
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

4-(Methylnitrosamino)-1-(3-pyridyl-N-oxide)-1-butanol is a pyridinium ion.