ChemSpider 2D Image | 3-[(1E)-2-Amino-2-hydroxyethylidene]-1-(2-chloroethyl)-1-nitrosourea | C5H9ClN4O3

3-[(1E)-2-Amino-2-hydroxyethylidene]-1-(2-chloroethyl)-1-nitrosourea

  • Molecular FormulaC5H9ClN4O3
  • Average mass208.603 Da
  • Monoisotopic mass208.036316 Da
  • ChemSpider ID95778803

  • Double-bond stereo - Double-bond stereo

More details:

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

3-[(1E)-2-Amino-2-hydroxyethyliden]-1-(2-chlorethyl)-1-nitrosoharnstoff [German] [ACD/IUPAC Name]
3-[(1E)-2-Amino-2-hydroxyethylidene]-1-(2-chloroethyl)-1-nitrosourea [ACD/IUPAC Name]
3-[(1E)-2-Amino-2-hydroxyéthylidène]-1-(2-chloroéthyl)-1-nitrosourée [French] [ACD/IUPAC Name]
Urea, N'-[(1E)-2-amino-2-hydroxyethylidene]-N-(2-chloroethyl)-N-nitroso- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 327.8±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.1±6.0 kJ/mol
Flash Point: 152.1±30.7 °C
Index of Refraction: 1.597
Molar Refractivity: 44.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.57
ACD/LogD (pH 7.4): -0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.53
Polar Surface Area: 108 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 66.0±7.0 dyne/cm
Molar Volume: 131.2±7.0 cm3

Click to predict properties on the Chemicalize site


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