ChemSpider 2D Image | 1-Chloro-3-(3-nitro-1-pyrazolidinyl)-2-propanol | C6H12ClN3O3

1-Chloro-3-(3-nitro-1-pyrazolidinyl)-2-propanol

  • Molecular FormulaC6H12ClN3O3
  • Average mass209.631 Da
  • Monoisotopic mass209.056717 Da
  • ChemSpider ID111545293

More details:

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

1-Chlor-3-(3-nitro-1-pyrazolidinyl)-2-propanol [German] [ACD/IUPAC Name]
1-Chloro-3-(3-nitro-1-pyrazolidinyl)-2-propanol [ACD/IUPAC Name]
1-Chloro-3-(3-nitro-1-pyrazolidinyl)-2-propanol [French] [ACD/IUPAC Name]
1-Pyrazolidineethanol, α-(chloromethyl)-3-nitro- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 376.0±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.1±6.0 kJ/mol
Flash Point: 181.2±30.7 °C
Index of Refraction: 1.564
Molar Refractivity: 47.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -0.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.43
ACD/LogD (pH 7.4): -2.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 18.9±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 146.6±5.0 cm3

Click to predict properties on the Chemicalize site


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