Acetonitrile, [(4-methylphenyl)nitrosoamino]- structure

Acetonitrile, [(4-methylphenyl)nitrosoamino]-

N-(cyanomethyl)-N-(4-methylphenyl)nitrous amide

Also Known As: Acetonitrile, [(4-methylphenyl)nitrosoamino]-|N-(cyanomethyl)-N-(4-methylphenyl)nitrous amide|T0510-7447

CAS: 829-28-7
Molecular Formula C9H9N3O
Molecular Weight 175.07455 g/mol
LogP 2.0064
Topological Polar Surface Area 56.46 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 175.07455
Monoisotopic Mass 175.07455
Heavy Atoms 13
Complexity 325.7082

Chemical Identifiers

CAS Number 829-28-7
SMILES CC1=CC=C(C=C1)N(CC#N)N=O

Product Overview

Acetonitrile, [(4-methylphenyl)nitrosoamino]- (CAS 829-28-7), with molecular formula C9H9N3O and molecular weight 175.07455 g/mol. IUPAC: N-(cyanomethyl)-N-(4-methylphenyl)nitrous amide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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