ChemSpider 2D Image | 3-Hydroxy-3-nitropropanoic acid | C3H5NO5

3-Hydroxy-3-nitropropanoic acid

  • Molecular FormulaC3H5NO5
  • Average mass135.076 Da
  • Monoisotopic mass135.016769 Da
  • ChemSpider ID61059291

More details:

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

3-Hydroxy-3-nitropropanoic acid [ACD/IUPAC Name]
3-Hydroxy-3-nitropropansäure [German] [ACD/IUPAC Name]
Acide 3-hydroxy-3-nitropropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-hydroxy-3-nitro- [ACD/Index Name]
905107-83-7 [RN]
MFCD01883923

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

Density: 1.6±0.1 g/cm3
Boiling Point: 335.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 162.8±15.0 °C
Index of Refraction: 1.512
Molar Refractivity: 25.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): -3.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 9.9±0.5 10-24cm3
Surface Tension: 75.9±3.0 dyne/cm
Molar Volume: 83.3±3.0 cm3

Click to predict properties on the Chemicalize site


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