ChemSpider 2D Image | (2R)-1-Hydroxy-2-propanyl nitrate | C3H7NO4

(2R)-1-Hydroxy-2-propanyl nitrate

  • Molecular FormulaC3H7NO4
  • Average mass121.092 Da
  • Monoisotopic mass121.037506 Da
  • ChemSpider ID61804511

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1-Hydroxy-2-propanyl nitrate [ACD/IUPAC Name]
(2R)-1-Hydroxy-2-propanylnitrat [German] [ACD/IUPAC Name]
1,2-Propanediol, 2-nitrate, (2R)- [ACD/Index Name]
Nitrate de (2R)-1-hydroxy-2-propanyle [French] [ACD/IUPAC Name]
121486-82-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 113.6±13.0 °C at 760 mmHg
Vapour Pressure: 10.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.0±6.0 kJ/mol
Flash Point: 22.5±19.8 °C
Index of Refraction: 1.443
Molar Refractivity: 25.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.33
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.92
ACD/KOC (pH 5.5): 55.48
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.92
ACD/KOC (pH 7.4): 55.48
Polar Surface Area: 75 Å2
Polarizability: 10.0±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 95.1±3.0 cm3

Click to predict properties on the Chemicalize site


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