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13256-07-0

13256-07-0 structural image
Product Name: N-AMYL-N-METHYLNITROSAMINE
Formula: C6H14N2O
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COMPUTED DESCRIPTORS

Molecular Weight 130.19 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 130.110613074 g/mol
Monoisotopic Mass 130.110613074 g/mol
Topological Polar Surface Area 32.7 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 75.5
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

N-methyl-N-pentylnitrosamine is a nitrosamine that has methyl and pentyl substituents. It is a potent oesophageal carcinogen. It has a role as a carcinogenic agent.