ChemSpider 2D Image | Methyl 4-{N-(2-furylmethyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate | C24H23F3N2O5

Methyl 4-{N-(2-furylmethyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate

  • Molecular FormulaC24H23F3N2O5
  • Average mass476.445 Da
  • Monoisotopic mass476.155914 Da
  • ChemSpider ID22684088

More details:

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

1H-Pyrrole-2-carboxylic acid, 4-[2-[(2-furanylmethyl)[4-(trifluoromethyl)benzoyl]amino]acetyl]-1,3,5-trimethyl-, methyl ester [ACD/Index Name]
4-{N-(2-Furylméthyl)-N-[4-(trifluorométhyl)benzoyl]glycyl}-1,3,5-triméthyl-1H-pyrrole-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-{N-(2-furylmethyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate [ACD/IUPAC Name]
Methyl-4-{N-(2-furylmethyl)-N-[4-(trifluormethyl)benzoyl]glycyl}-1,3,5-trimethyl-1H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 626.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.4±31.5 °C
Index of Refraction: 1.552
Molar Refractivity: 118.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.75
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 919.40
ACD/KOC (pH 5.5): 4601.27
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 919.40
ACD/KOC (pH 7.4): 4601.27
Polar Surface Area: 82 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 39.2±7.0 dyne/cm
Molar Volume: 370.0±7.0 cm3

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