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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:
Molecular Weight:
116.16
MDL number:
UNSPSC Code:
12352116
PubChem Substance ID:
NACRES:
NA.25
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form

liquid

Quality Level

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

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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E Suzuki et al.
Japanese journal of cancer research : Gann, 76(3), 184-191 (1985-03-01)
In order to compare the extents of metabolic alpha-hydroxylation of the two alkyl groups in unsymmetrical N-nitrosodialkylamines, N-nitroso-N-alkylbutylamines (alkyl = methyl, ethyl, propyl, butyl, and amyl) were incubated with liver microsomes prepared from phenobarbital- or polychlorinated biphenyl (PCB)-treated and untreated
W Lijinsky et al.
Carcinogenesis, 1(2), 157-160 (1980-02-01)
Nitrosomethyl-n-butylamine and its derivatives, labeled with deuterium in the methyl group or at the alpha position of the butyl group, were given to rats in drinking water at equimolar doses for approximately 20 weeks. Two concentrations were used, 16 mg/l
B Ludeke et al.
IARC scientific publications, (105)(105), 286-293 (1991-01-01)
Aliphatic methylalkylnitrosamines with a chain length of three to six carbon atoms are powerful oesophageal carcinogens in rats and have been shown to methylate target organ DNA preferentially. This class of carcinogens is efficiently metabolized not only in the oesophageal
P P Roller et al.
IARC scientific publications, (41)(41), 199-208 (1982-01-01)
Electron-impact mass spectra of N-nitrosomethyl-n-butylamine, 5 of its specifically deuterated anologs and its methyl-n-hexyl and methyl-n-octyl homologs have been examined. Hydrogen abstraction by the nitrosamino moiety dominates the rearrangement ions, especially at low ionization energy. All compounds exhibited the (M-OH)+
T Koreeda et al.
Anticancer research, 19(5B), 4139-4143 (2000-01-11)
The inhibitory effect of a synthetic retinoid, ethyl alltrans-9-(4-methoxy-2, 3, 6-trimethyl-phenyl)-3, 7-dimethyl-2, 4, 6, 8-nonatetraenoate (Tigason), on esophageal carcinogenesis in F344 rats induced by N-nitroso-N-methylbutylamine (NMBA) was evaluated. The animals were given NMBA daily in their drinking water for 21

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