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Substance Name: N-Methyl-N'-phenyl-N-nitrosourea
RN: 21561-99-9
InChIKey: GZHRIEZGSLSDRF-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C8-H9-N3-O2

Molecular Weight

  • 179.178
 
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Names and Synonyms

Name of Substance

  • N-Methyl-N'-phenyl-N-nitrosourea

Synonyms

  • 1-Methyl-1-nitroso-3-phenylurea
  • 3-Phenyl-1-methyl-1-nitrosoharnstoff
  • 3-Phenyl-1-methyl-1-nitrosoharnstoff [German]
  • BRN 2806200
  • CCRIS 9191
  • Methylphenylnitrosourea
  • MPNU
  • N-Methyl-N'-phenyl-N-nitrosourea
  • N-Methyl-N-nitroso-N'-phenylurea
  • Nitrosomethylphenylurea
  • NSC 68456
  • Urea, 1-methyl-1-nitroso-3-phenyl-

Systematic Names

  • N-Methyl-N-nitroso-N'-phenylurea
  • Urea, 1-methyl-1-nitroso-3-phenyl-
  • Urea, N-methyl-N-nitroso-N'-phenyl- (9CI)

Registry Numbers

CAS Registry Number

  • 21561-99-9

System Generated Number

  • 0021561999

Structure Descriptors

InChI

1S/C8H9N3O2/c1-11(10-13)8(12)9-7-5-3-2-4-6-7/h2-6H,1H3,(H,9,12)

InChIKey

GZHRIEZGSLSDRF-UHFFFAOYSA-N

Smiles

N(N=O)(C)C(=O)Nc1ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.72 (none)   EXP
Water Solubility 1890 mg/L 25 EST
Vapor Pressure 9.32E-05 mm Hg 25 EST
Henry's Law Constant 5.47E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.32E-11 cm3/molecule-sec 25 EST

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