ChemSpider 2D Image | 2-nitrooxy-2-propanol | C3H7NO4

2-nitrooxy-2-propanol

  • Molecular FormulaC3H7NO4
  • Average mass121.092 Da
  • Monoisotopic mass121.037506 Da
  • ChemSpider ID24774177

More details:

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

2,2-Propanediol, 2-nitrate [ACD/Index Name]
2-Hydroxy-2-propanyl nitrate [ACD/IUPAC Name]
2-Hydroxy-2-propanylnitrat [German] [ACD/IUPAC Name]
2-nitrooxy-2-propanol
Nitrate de 2-hydroxy-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 163.4±23.0 °C at 760 mmHg
Vapour Pressure: 0.7±0.7 mmHg at 25°C
Enthalpy of Vaporization: 46.6±6.0 kJ/mol
Flash Point: 52.6±22.6 °C
Index of Refraction: 1.445
Molar Refractivity: 25.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.82
ACD/KOC (pH 5.5): 53.38
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.82
ACD/KOC (pH 7.4): 53.36
Polar Surface Area: 75 Å2
Polarizability: 10.0±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 94.8±3.0 cm3

Click to predict properties on the Chemicalize site


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