ChemSpider 2D Image | 1-(2-Chloroethyl)-3-[(2E)-1,1-dihydroxy-2-propanylidene]-1-nitrosourea | C6H10ClN3O4

1-(2-Chloroethyl)-3-[(2E)-1,1-dihydroxy-2-propanylidene]-1-nitrosourea

  • Molecular FormulaC6H10ClN3O4
  • Average mass223.614 Da
  • Monoisotopic mass223.035980 Da
  • ChemSpider ID95555710

  • Double-bond stereo - Double-bond stereo

More details:

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

1-(2-Chlorethyl)-3-[(2E)-1,1-dihydroxy-2-propanyliden]-1-nitrosoharnstoff [German] [ACD/IUPAC Name]
1-(2-Chloroethyl)-3-[(2E)-1,1-dihydroxy-2-propanylidene]-1-nitrosourea [ACD/IUPAC Name]
1-(2-Chloroéthyl)-3-[(2E)-1,1-dihydroxy-2-propanylidène]-1-nitrosourée [French] [ACD/IUPAC Name]
Urea, N-(2-chloroethyl)-N'-[(1E)-2,2-dihydroxy-1-methylethylidene]-N-nitroso- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 330.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.4±6.0 kJ/mol
Flash Point: 153.7±30.7 °C
Index of Refraction: 1.568
Molar Refractivity: 48.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.71
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.45
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.43
Polar Surface Area: 103 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 56.9±7.0 dyne/cm
Molar Volume: 147.0±7.0 cm3

Click to predict properties on the Chemicalize site


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