ChemSpider 2D Image | 4-(Ethoxycarbonyl)-1,2-oxazole-3-carboxylic acid | C7H7NO5

4-(Ethoxycarbonyl)-1,2-oxazole-3-carboxylic acid

  • Molecular FormulaC7H7NO5
  • Average mass185.134 Da
  • Monoisotopic mass185.032425 Da
  • ChemSpider ID60747985

More details:

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

1379200-14-2 [RN]
3,4-Isoxazoledicarboxylic acid, 4-ethyl ester [ACD/Index Name]
4-(Ethoxycarbonyl)-1,2-oxazol-3-carbonsäure [German] [ACD/IUPAC Name]
4-(Ethoxycarbonyl)-1,2-oxazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 4-(éthoxycarbonyl)-1,2-oxazole-3-carboxylique [French] [ACD/IUPAC Name]
MFCD20659215

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

Density: 1.4±0.1 g/cm3
Boiling Point: 376.1±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.8±3.0 kJ/mol
Flash Point: 181.3±23.7 °C
Index of Refraction: 1.516
Molar Refractivity: 40.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.02
ACD/LogD (pH 5.5): -2.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 90 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 132.4±3.0 cm3

Click to predict properties on the Chemicalize site


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