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Substance Name: N-methyl-n-benzylnitrosamine
RN: 937-40-6
InChIKey: NGXUJKBJBFLCAR-UHFFFAOYSA-N

Classification Codes

  • Carcinogens
  • Mutation Data
  • Noxae
  • Tumor Data

Molecular Formula

  • C8-H10-N2-O

Molecular Weight

  • 150.18
 
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Names and Synonyms

Name of Substance

  • N-Methyl-N-benzylnitrosamine
  • Nitrosobenzylmethylamine

Synonyms

  • 4-16-00-00871 (Beilstein Handbook Reference)
  • Benzyl(methyl)nitrosamine
  • BRN 1841634
  • CCRIS 1120
  • Methyl-benzyl-nitrosoamin
  • Methyl-benzyl-nitrosoamin [German]
  • Methylbenzylnitrosamine
  • N-Methyl-N-benzylnitrosamine
  • N-Methyl-N-nitrosobenzylamine
  • N-Nitroso-N-methyl-N-benzylamine
  • N-Nitroso-N-methylbenzylamine
  • N-Nitrosobenzylmethylamine
  • N-Nitrosomethylbenzylamine
  • Nitrosobenzylmethylamine

Systematic Names

  • Benzenemethanamine, N-methyl-N-nitroso-
  • Benzylamine, N-methyl-N-nitroso-
  • N-Methyl-N-benzylnitrosamine
  • N-Methyl-N-nitroso-benzenemethanamine

Registry Numbers

CAS Registry Number

  • 937-40-6

System Generated Number

  • 0000937406

Structure Descriptors

InChI

1S/C8H10N2O/c1-10(9-11)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3

InChIKey

NGXUJKBJBFLCAR-UHFFFAOYSA-N

Smiles

c1(CN(N=O)C)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 18mg/kg (18mg/kg)   Naturwissenschaften. Vol. 50, Pg. 100, 1963.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.55 (none)   EXP
Water Solubility 4510 mg/L 24 EXP
Vapor Pressure 3.57E-03 mm Hg 25 EST
Henry's Law Constant 1.20E-05 atm-m3/mole 37 EXP
Atmospheric OH Rate Constant 1.48E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.