ChemSpider 2D Image | Diethyl 3-hydroxy-1H-pyrrole-2,4-dicarboxylate | C10H13NO5

Diethyl 3-hydroxy-1H-pyrrole-2,4-dicarboxylate

  • Molecular FormulaC10H13NO5
  • Average mass227.214 Da
  • Monoisotopic mass227.079376 Da
  • ChemSpider ID17825010

More details:

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

1H-Pyrrole-2,4-dicarboxylic acid, 3-hydroxy-, diethyl ester [ACD/Index Name]
3-Hydroxy-1H-pyrrole-2,4-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 3-hydroxy-1H-pyrrole-2,4-dicarboxylate [ACD/IUPAC Name]
Diethyl-3-hydroxy-1H-pyrrol-2,4-dicarboxylat [German] [ACD/IUPAC Name]
2,4-diethyl 3-hydroxy-1H-pyrrole-2,4-dicarboxylate
65171-73-5 [RN]
MFCD08898980

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

Density: 1.3±0.1 g/cm3
Boiling Point: 362.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.2±3.0 kJ/mol
Flash Point: 173.0±26.5 °C
Index of Refraction: 1.546
Molar Refractivity: 55.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 129.79
ACD/KOC (pH 5.5): 1133.09
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 129.78
ACD/KOC (pH 7.4): 1132.98
Polar Surface Area: 89 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 175.0±3.0 cm3

Click to predict properties on the Chemicalize site


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