ChemSpider 2D Image | 5-Formyl-2-oxo-2H-pyran-3-carboxylic acid | C7H4O5

5-Formyl-2-oxo-2H-pyran-3-carboxylic acid

  • Molecular FormulaC7H4O5
  • Average mass168.104 Da
  • Monoisotopic mass168.005875 Da
  • ChemSpider ID75726038

More details:

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

2H-Pyran-3-carboxylic acid, 5-formyl-2-oxo- [ACD/Index Name]
5-Formyl-2-oxo-2H-pyran-3-carbonsäure [German] [ACD/IUPAC Name]
5-Formyl-2-oxo-2H-pyran-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-formyl-2-oxo-2H-pyrane-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 324.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 62.3±6.0 kJ/mol
Flash Point: 140.4±21.4 °C
Index of Refraction: 1.696
Molar Refractivity: 36.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.93
ACD/LogD (pH 5.5): -4.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 104.6±3.0 dyne/cm
Molar Volume: 95.4±3.0 cm3

Click to predict properties on the Chemicalize site


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