ChemSpider 2D Image | 4-Amino-5-({[(2-chloroethyl)(nitroso)carbamoyl]amino}methyl)-2-methylpyrimidin-1-ium | C9H14ClN6O2

4-Amino-5-({[(2-chloroethyl)(nitroso)carbamoyl]amino}methyl)-2-methylpyrimidin-1-ium

  • Molecular FormulaC9H14ClN6O2
  • Average mass273.699 Da
  • Monoisotopic mass273.086121 Da
  • ChemSpider ID128919620

  • Charge - Charge

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-Amino-5-({[(2-chlorethyl)(nitroso)carbamoyl]amino}methyl)-2-methylpyrimidin-1-ium [German] [ACD/IUPAC Name]
4-Amino-5-({[(2-chloroethyl)(nitroso)carbamoyl]amino}methyl)-2-methylpyrimidin-1-ium [ACD/IUPAC Name]
4-Amino-5-({[(2-chloroéthyl)(nitroso)carbamoyl]amino}méthyl)-2-méthylpyrimidin-1-ium [French] [ACD/IUPAC Name]
Urea, N'-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(2-chloroethyl)-N-nitroso-, conjugate monoacid [ACD/Index Name]
nimustine cation
nimustine(1+)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.19
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.47
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.07
ACD/KOC (pH 7.4): 36.29
Polar Surface Area: 115 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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