ChemSpider 2D Image | formyl-1-methyl-1H-pyrrole-2-carboxylate | C7H6NO3

formyl-1-methyl-1H-pyrrole-2-carboxylate

  • Molecular FormulaC7H6NO3
  • Average mass152.128 Da
  • Monoisotopic mass152.035324 Da
  • ChemSpider ID25943286

  • Charge - Charge

More details:

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

1H-Pyrrole-2-carboxylic acid, 3-formyl-1-methyl-, ion(1-) [ACD/Index Name]
3-Formyl-1-methyl-1H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]
3-Formyl-1-methyl-1H-pyrrole-2-carboxylate [ACD/IUPAC Name]
3-Formyl-1-méthyl-1H-pyrrole-2-carboxylate [French] [ACD/IUPAC Name]
formyl-1-methyl-1H-pyrrole-2-carboxylate

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

Density:
Boiling Point: 347.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 164.1±23.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.61
ACD/LogD (pH 5.5): -1.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 62 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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