ChemSpider 2D Image | Methyl 2,5-dimethyl-4-{2-[(4-~3~H)phenylmethyl]benzoyl}-1H-pyrrole-3-carboxylate | C22H20TNO3

Methyl 2,5-dimethyl-4-{2-[(4-3H)phenylmethyl]benzoyl}-1H-pyrrole-3-carboxylate

  • Molecular FormulaC22H20TNO3
  • Average mass349.415 Da
  • Monoisotopic mass349.160370 Da
  • ChemSpider ID8264709

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Pyrrole-3-carboxylic acid, 2,5-dimethyl-4-[2-(phenyl-4-t-methyl)benzoyl]-, methyl ester [ACD/Index Name]
2,5-Diméthyl-4-{2-[(4-3H)phénylméthyl]benzoyl}-1H-pyrrole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 2,5-dimethyl-4-{2-[(4-3H)phenylmethyl]benzoyl}-1H-pyrrole-3-carboxylate [ACD/IUPAC Name]
Methyl-2,5-dimethyl-4-{2-[(4-3H)phenylmethyl]benzoyl}-1H-pyrrol-3-carboxylat [German] [ACD/IUPAC Name]

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

Density:
Boiling Point: 547.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 285.1±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4537.46
ACD/KOC (pH 5.5): 14425.79
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4537.46
ACD/KOC (pH 7.4): 14425.79
Polar Surface Area: 59 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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