ChemSpider 2D Image | 3-Methyl-2-(5-~2~H)furancarboxylic acid | C6H5DO3

3-Methyl-2-(5-2H)furancarboxylic acid

  • Molecular FormulaC6H5DO3
  • Average mass127.116 Da
  • Monoisotopic mass127.037971 Da
  • ChemSpider ID77494187

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Furan-5-d-carboxylic acid, 3-methyl- [ACD/Index Name]
3-Methyl-2-(5-2H)furancarbonsäure [German] [ACD/IUPAC Name]
3-Methyl-2-(5-2H)furancarboxylic acid [ACD/IUPAC Name]
Acide 3-méthyl-2-(5-2H)furanecarboxylique [French] [ACD/IUPAC Name]
78742-93-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 236.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.0±3.0 kJ/mol
Flash Point: 96.8±21.8 °C
Index of Refraction: 1.512
Molar Refractivity: 30.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): -0.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.10
ACD/LogD (pH 7.4): -1.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 50 Å2
Polarizability: 12.0±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 101.0±3.0 cm3

Click to predict properties on the Chemicalize site


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