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2820-55-5

2820-55-5 structural image
Product Name: (2'S)-Nicotine 1-Oxide
Formula: C10H14N2O
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COMPUTED DESCRIPTORS

Molecular Weight 178.23 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 178.110613074 g/mol
Monoisotopic Mass 178.110613074 g/mol
Topological Polar Surface Area 28.7 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 174
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

(S)-nicotine 1-N-oxide is a member of the class of pyridine N-oxides obtained by oxidation of the pyridine nitrogen of (S)-nicotine. It is a member of pyridine N-oxides and a N-alkylpyrrolidine. It is functionally related to a (S)-nicotine.