ChemSpider 2D Image | 5-{[Carboxy(hydroxy)methyl]carbamoyl}-3-furoic acid | C8H7NO7

5-{[Carboxy(hydroxy)methyl]carbamoyl}-3-furoic acid

  • Molecular FormulaC8H7NO7
  • Average mass229.144 Da
  • Monoisotopic mass229.022247 Da
  • ChemSpider ID96934480

More details:

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

3-Furancarboxylic acid, 5-[[(carboxyhydroxymethyl)amino]carbonyl]- [ACD/Index Name]
5-{[Carboxy(hydroxy)methyl]carbamoyl}-3-furoesäure [German] [ACD/IUPAC Name]
5-{[Carboxy(hydroxy)methyl]carbamoyl}-3-furoic acid [ACD/IUPAC Name]
Acide 5-{[carboxy(hydroxy)méthyl]carbamoyl}-3-furoïque [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 616.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 326.3±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 46.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.25
ACD/LogD (pH 5.5): -4.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 137 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 89.2±3.0 dyne/cm
Molar Volume: 134.1±3.0 cm3

Click to predict properties on the Chemicalize site


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