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Substance Name: 1-(2-Chloroethyl)-1-nitrosourea
RN: 2365-30-2
InChIKey: NVKGVBZZSJFQLM-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C3-H6-Cl-N3-O2

Molecular Weight

  • 151.552
 
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Names and Synonyms

Name of Substance

  • 1-(2-Chloroethyl)-1-nitrosourea

Synonyms

  • (Ethyl-3H)-N-(2-chloroethyl)-N-nitrosourea
  • 1-(2-Chloroethyl)-1-nitrosourea
  • 1-Nitroso-1-(2-chloroethyl)urea
  • 2-Chloroethyl-N-nitrosourea
  • BRN 2246259
  • CCRIS 862
  • Chloroethylnitrosourea
  • CNU
  • MP 655
  • N-(2-Chloroethyl)-N-nitrosourea
  • N-Chloroethyl-N-nitrosourea
  • N-Nitroso-2-chloroethylurea
  • NSC 47547
  • SKI 28404

Systematic Names

  • N-(2-Chloroethyl)-N-nitrosourea
  • Urea, 1-(2-chloroethyl)-1-nitroso-
  • Urea, N-(2-chloroethyl)-N-nitroso- (9CI)

Registry Numbers

CAS Registry Number

  • 2365-30-2

System Generated Number

  • 0002365302

Structure Descriptors

InChI

1S/C3H6ClN3O2/c4-1-2-7(6-9)3(5)8/h1-2H2,(H2,5,8)

InChIKey

NVKGVBZZSJFQLM-UHFFFAOYSA-N

Smiles

NC(=O)N(N=O)CCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intravenous 4700ug/kg (4.7mg/kg)   Antibiotics and Chemotherapy Vol. 23, Pg. 64, 1978.
mouse LD50 intraperitoneal 4368ug/kg (4.368mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.57 (none)   EXP
Water Solubility 2.44E+04 mg/L 25 EST
Vapor Pressure 2.49E-03 mm Hg 25 EST
Henry's Law Constant 4.63E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.82E-12 cm3/molecule-sec 25 EST

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