ChemSpider 2D Image | 5-Formyl-4-(methoxycarbonyl)-2-furoic acid | C8H6O6

5-Formyl-4-(methoxycarbonyl)-2-furoic acid

  • Molecular FormulaC8H6O6
  • Average mass198.130 Da
  • Monoisotopic mass198.016434 Da
  • ChemSpider ID71089882

More details:

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

2,4-Furandicarboxylic acid, 5-formyl-, 4-methyl ester [ACD/Index Name]
5-Formyl-4-(methoxycarbonyl)-2-furoesäure [German] [ACD/IUPAC Name]
5-Formyl-4-(methoxycarbonyl)-2-furoic acid [ACD/IUPAC Name]
Acide 5-formyl-4-(méthoxycarbonyl)-2-furoïque [French] [ACD/IUPAC Name]
2248386-02-7 [RN]
5-formyl-4-(methoxycarbonyl)furan-2-carboxylic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 423.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.5±3.0 kJ/mol
Flash Point: 210.1±28.7 °C
Index of Refraction: 1.569
Molar Refractivity: 44.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -2.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 94 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 134.3±3.0 cm3

Click to predict properties on the Chemicalize site


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