chempirical

Lomustine

C9H16ClN3O2CAS 13010-47-4233.70 g/mol

Open in Covalent MOL file
ONNClOHN
Alkyl halide

Properties

Molecular formula
C9H16ClN3O2
Molar mass
233.70 g/mol
Exact mass
233.0931 Da
Melting point
89 °C
logP
2.46Crippen estimate
Polar surface area
65.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
13010-47-4
SMILES
O=NN(CCCl)C(O)=NC1CCCCC1
InChIKey
GQYIWUVLTXOXAJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H16ClN3O2/c10-6-7-13(12-15)9(14)11-8-4-2-1-3-5-8/h8H,1-7H2,(H,11,14)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

22 names · show all
  • Urea, N-(2-chloroethyl)-N′-cyclohexyl-N-nitroso-
  • Urea, 1-(2-chloroethyl)-3-cyclohexyl-1-nitroso-
  • N-(2-Chloroethyl)-N′-cyclohexyl-N-nitrosourea
  • 3-Cyclohexyl-1-(2-chloroethyl)-1-nitrosourea
  • CCNU
  • 1-(2-Chloroethyl)-3-cyclohexyl-1-nitrosourea
  • NSC 79037
  • 1-(2-Chloroethyl)-3-cyclohexylnitrosourea
  • ICIG 1109
  • Belustine
  • 1-(2-Chloroethyl)-1-nitroso-3-cyclohexylurea
  • Lomustin
  • CeeNU
  • CiNu
  • Chloroethylcyclohexylnitrosourea
  • SRI 2200
  • Cecenu
  • NCI C04740
  • RB 1509
  • Lustine
  • Moostine
  • Lomtin

Work with Lomustine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Carmustine154-93-856 % similar Fotemustine92118-27-949 % similar Ranimustine58994-96-041 % similar Nimustine42471-28-337 % similar 1-(4-Amino-2-methylpyrimidin-5-yl)methyl-3-(2-chloroethyl)-3-nitrosourea hydrochloride55661-38-635 % similar Hexythiazox78587-05-033 % similar Dicyclohexylurea2387-23-733 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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