ChemSpider 2D Image | 6-Oxo-6H-1,2-oxazine-3-carboxylic acid | C5H3NO4

6-Oxo-6H-1,2-oxazine-3-carboxylic acid

  • Molecular FormulaC5H3NO4
  • Average mass141.082 Da
  • Monoisotopic mass141.006210 Da
  • ChemSpider ID108293810

More details:

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

6H-1,2-Oxazine-3-carboxylic acid, 6-oxo- [ACD/Index Name]
6-Oxo-6H-1,2-oxazin-3-carbonsäure [German] [ACD/IUPAC Name]
6-Oxo-6H-1,2-oxazine-3-carboxylic acid [ACD/IUPAC Name]
Acide 6-oxo-6H-1,2-oxazine-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 309.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.5±6.0 kJ/mol
Flash Point: 141.2±23.2 °C
Index of Refraction: 1.603
Molar Refractivity: 30.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.95
ACD/LogD (pH 5.5): -3.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 65.4±7.0 dyne/cm
Molar Volume: 87.4±7.0 cm3

Click to predict properties on the Chemicalize site


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