CAS 10125-76-5 | 1,1'-Biphenyl, 4-nitroso- | CAS Number 10125-76-5

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10125-76-5 | 1,1'-Biphenyl, 4-nitroso-

CAS No: 10125-76-5 Catalog No: AG000422 MDL No:

Product Description

Catalog Number:

AG000422

Chemical Name:

1,1'-Biphenyl, 4-nitroso-

CAS Number:

10125-76-5

Molecular Formula:

C12H9NO

Molecular Weight:

183.2060

IUPAC Name:

1-nitroso-4-phenylbenzene

InChI:

InChI=1S/C12H9NO/c14-13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H

InChI Key:

LLRWRZXFCFYZCL-UHFFFAOYSA-N

SMILES:

O=Nc1ccc(cc1)c1ccccc1

Properties

Complexity:

179

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

183.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

183.21g/mol

Monoisotopic Mass:

183.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4

Literature

Title	Journal
Cadmium alters the biotransformation of carcinogenic aromatic amines by arylamine N-acetyltransferase xenobiotic-metabolizing enzymes: molecular, cellular, and in vivo studies.	Environmental health perspectives 20101201
Isoform-selective inactivation of human arylamine N-acetyltransferases by reactive metabolites of carcinogenic arylamines.	Chemical research in toxicology 20091201
Human arylamine N-acetyltransferase 1: in vitro and intracellular inactivation by nitrosoarene metabolites of toxic and carcinogenic arylamines.	Chemical research in toxicology 20081001
Irreversible inactivation of arylamine N-acetyltransferases in the presence of N-hydroxy-4-acetylaminobiphenyl: a comparison of human and hamster enzymes.	Chemical research in toxicology 20050201