N-Nitroso-N-methyl-4-aminobutyric Acid - CAS 61445-55-4

N-Nitroso-N-methyl-4-aminobutyric Acid (CAS 61445-55-4) is a tobacco-specific nitrosamine carcinogen.It is oxidized to the reactive metabolite methyl-2-oxopropylnitrosamine (MOPN) in isolated rat liver mitochondria.The study shows that it induced bladder transitional cell carcinomas in rats when administered in the drinking water at a concentration of 300 mg/L per day.

Catalog Number: R000499

CAS Number: 61445-55-4

PubChem Substance ID:355188207

Molecular Formula: C5H10N2O3

Molecular Weight:146.146

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

Synonyms4-(Methylnitrosoamino)butanoic Acid; N-Methyl-N-(3-carboxypropyl)nitrosamine ; NMBA;

Property

Molecular Formula: C5H10N2O3
Molecular Weight146.146
Purity≥95%
StorageStore at RT

Computed Descriptor

IUPAC Name4-[methyl(nitroso)amino]butanoic acid
InChIInChI=1S/C5H10N2O3/c1-7(6-10)4-2-3-5(8)9/h2-4H2,1H3,(H,8,9)
InChIKeySJLBIPLIGYWGJV-UHFFFAOYSA-N
SMILESCN(CCCC(=O)O)N=O