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16543-55-8

16543-55-8 structural image
Product Name: N'-NITROSONORNICOTINE
Formula: C9H11N3O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description N-nitrosonornicotine appears as white crystalline flakes or yellow oil that solidifies on standing in the cold. (NTP, 1992)
Color/Form Yellow oil
Boiling Point 309 °F at 0.2 mmHg (NTP, 1992)
Melting Point 117 °F (NTP, 1992)
Solubility Insoluble (NTP, 1992)
Vapor Pressure 0.000512 [mmHg]
Decomposition When heated to decomp it emits toxic fumes of /oxides of nitrogen/.
Chemical Classes Nitrogen Compounds -> Nitrosamines

COMPUTED DESCRIPTORS

Molecular Weight 177.20 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 177.090211983 g/mol
Monoisotopic Mass 177.090211983 g/mol
Topological Polar Surface Area 45.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 186
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

N-nitrosonornicotine appears as white crystalline flakes or yellow oil that solidifies on standing in the cold. (NTP, 1992)