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N4007

Sigma-Aldrich

N-Nitroso-N-methylbutylamine

Synonym(s):

Methylbutylnitrosamine

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About This Item

Empirical Formula (Hill Notation):
C5H12N2O
CAS Number:
7068-83-9
Molecular Weight:
116.16
MDL number:
MFCD00056645
UNSPSC Code:
12352116
PubChem Substance ID:
24897361
NACRES:
NA.25

form

liquid

density

0.93 g/mL (lit.)

storage temp.

2-8°C

SMILES string

CCCCN(C)N=O

InChI

1S/C5H12N2O/c1-3-4-5-7(2)6-8/h3-5H2,1-2H3

InChI key

PKTSCJXWLVREKX-UHFFFAOYSA-N

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Packaging

Bulk package

pictograms

Skull and crossbonesHealth hazard
GHS06,GHS08

signalword

Danger

Hazard Classifications

Acute Tox. 1 Inhalation - Acute Tox. 2 Dermal - Acute Tox. 3 Oral - Carc. 1B

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Q Huang et al.
Cancer letters, 69(2), 107-116 (1993-04-30)
We studied the metabolism of methyl-n-butyl-nitrosamine (MBN), a carcinogen for the rat esophagus and liver. The 2-, 3- and 4-hydroxy derivatives were identified as new metabolites of MBN. In studies on tissue slices freshly removed from MRC-Wistar rats, MBN metabolism
Nozomi Tsutsumi et al.
Bioorganic & medicinal chemistry, 18(23), 8284-8288 (2010-10-30)
N-Nitrosodialkylamines are known to be potent indirect-acting mutagens/carcinogens, which are activated by cytochrome P450. The reaction product of N-nitroso-N-methylbutylamine (NMB) with modified Fenton's reagent supplemented with copper salt (Fe²(+)-Cu²(+)-H₂O₂) was reported to be mutagenic in Salmonella typhimurium TA1535 without S9
W Lijinsky et al.
Journal of cancer research and clinical oncology, 106(3), 171-175 (1983-01-01)
The carcinogenic effectiveness of nitrosomethyl-n-butylamine,-n-hexylamine and -n-heptylamine was compared by administration to F344 rats at various concentrations in drinking water and by gavage in oil. Nitrosomethylbutylamine induced only tumors of the upper gastrointestinal tract, and was very toxic. Nitrosomethylhexylamine was
M Lee et al.
Cancer research, 49(6), 1470-1474 (1989-03-15)
Metabolic activation may be a key step in determining the tissue specificity of carcinogenic nitrosamines. In previous work, we characterized P450IIE1 (an acetone/ethanol-inducible form of cytochrome P-450) as the major enzyme for the metabolic activation of N-nitrosodimethylamine. In this work
T Gichner et al.
Mutagenesis, 1(2), 107-109 (1986-03-01)
The organic solvents dimethylsulphoxide (DMSO), acetone, ethanol and dimethylformamide inhibited the mutagenic activity of the promutagens dimethylnitrosamine and methylbutylnitrosamine in a higher plant Arabidopsis thaliana. In contrast, the direct-acting mutagens N-methyl-N'-nitro-N-nitrosoguanidine (MNNG) and N-methyl-N-nitrosourea (MNU) were not affected by the
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