ChemSpider 2D Image | 4-Oxovaline | C5H9NO3

4-Oxovaline

  • Molecular FormulaC5H9NO3
  • Average mass131.130 Da
  • Monoisotopic mass131.058243 Da
  • ChemSpider ID22376472

More details:

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

4-Oxovalin [German] [ACD/IUPAC Name]
4-Oxovaline [ACD/IUPAC Name]
4-Oxovaline [French] [ACD/IUPAC Name]
Valine, 4-oxo- [ACD/Index Name]
33966-02-8 [RN]
MFCD24496026

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

Density: 1.2±0.1 g/cm3
Boiling Point: 264.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 55.3±6.0 kJ/mol
Flash Point: 113.6±25.9 °C
Index of Refraction: 1.478
Molar Refractivity: 30.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -2.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 107.4±3.0 cm3

Click to predict properties on the Chemicalize site


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