ChemSpider 2D Image | 3-Acetyl-4-hydroxy-5-oxo-2,5-dihydro-2-furancarboxylic acid | C7H6O6

3-Acetyl-4-hydroxy-5-oxo-2,5-dihydro-2-furancarboxylic acid

  • Molecular FormulaC7H6O6
  • Average mass186.119 Da
  • Monoisotopic mass186.016434 Da
  • ChemSpider ID28706397

More details:

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

2-Furancarboxylic acid, 3-acetyl-2,5-dihydro-4-hydroxy-5-oxo- [ACD/Index Name]
3-Acetyl-4-hydroxy-5-oxo-2,5-dihydro-2-furancarbonsäure [German] [ACD/IUPAC Name]
3-Acetyl-4-hydroxy-5-oxo-2,5-dihydro-2-furancarboxylic acid [ACD/IUPAC Name]
Acide 3-acétyl-4-hydroxy-5-oxo-2,5-dihydro-2-furanecarboxylique [French] [ACD/IUPAC Name]
3-Acetyl-4-hydroxy-5-oxo-2,5-dihydrofuran-2-carboxylic acid
89966-23-4 [RN]
MFCD20654998

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

Density: 1.8±0.1 g/cm3
Boiling Point: 548.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 95.2±6.0 kJ/mol
Flash Point: 234.6±23.6 °C
Index of Refraction: 1.608
Molar Refractivity: 36.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -5.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 14.5±0.5 10-24cm3
Surface Tension: 92.4±3.0 dyne/cm
Molar Volume: 106.0±3.0 cm3

Click to predict properties on the Chemicalize site


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