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Substance Name: Diethylmethylnitrosourea
RN: 50285-72-8
InChIKey: IQUAIARLKRYQOY-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C6-H13-N3-O2

Molecular Weight

  • 159.188
 
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Names and Synonyms

Name of Substance

  • Diethylmethylnitrosourea

Synonyms

  • 1,1-Diethyl-3-methyl-3-nitrosourea
  • 1-Nitroso-1-methyl-3,3-diethylurea
  • BRN 2249848
  • CCRIS 5585
  • Diethylmethylnitrosourea
  • Nitroso-1,1-diethyl-3-methylurea
  • Nitrosomethyldiaethylharnstoff
  • Nitrosomethyldiethylurea

Systematic Names

  • 1,1-Diethyl-3-methyl-3-nitrosourea
  • Urea, 1,1-diethyl-3-methyl-3-nitroso-

Registry Numbers

CAS Registry Number

  • 50285-72-8

System Generated Number

  • 0050285728

Structure Descriptors

InChI

1S/C6H13N3O2/c1-4-9(5-2)6(10)8(3)7-11/h4-5H2,1-3H3

InChIKey

IQUAIARLKRYQOY-UHFFFAOYSA-N

Smiles

N(C(N(N=O)C)=O)(CC)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
hamster LD50 subcutaneous 283mg/kg (283mg/kg)   Cancer Letters Vol. 23, Pg. 177, 1984.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.11 (none)   EXP
Water Solubility 7780 mg/L 25 EST
Vapor Pressure 0.213 mm Hg 25 EST
Henry's Law Constant 8.42E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.55E-12 cm3/molecule-sec 25 EST

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