ChemSpider 2D Image | 2-Methoxy-N-(4-methylbenzyl)-N-({1-[3-(trifluoromethyl)benzyl]-1H-pyrrol-2-yl}methyl)ethanamine | C24H27F3N2O

2-Methoxy-N-(4-methylbenzyl)-N-({1-[3-(trifluoromethyl)benzyl]-1H-pyrrol-2-yl}methyl)ethanamine

  • Molecular FormulaC24H27F3N2O
  • Average mass416.479 Da
  • Monoisotopic mass416.207550 Da
  • ChemSpider ID22583532

More details:

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

1H-Pyrrole-2-methanamine, N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-1-[[3-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
2-Methoxy-N-(4-methylbenzyl)-N-({1-[3-(trifluormethyl)benzyl]-1H-pyrrol-2-yl}methyl)ethanamin [German] [ACD/IUPAC Name]
2-Methoxy-N-(4-methylbenzyl)-N-({1-[3-(trifluoromethyl)benzyl]-1H-pyrrol-2-yl}methyl)ethanamine [ACD/IUPAC Name]
2-Méthoxy-N-(4-méthylbenzyl)-N-({1-[3-(trifluorométhyl)benzyl]-1H-pyrrol-2-yl}méthyl)éthanamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 467.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 236.2±27.3 °C
Index of Refraction: 1.526
Molar Refractivity: 114.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.64
ACD/LogD (pH 5.5): 2.75
ACD/BCF (pH 5.5): 21.99
ACD/KOC (pH 5.5): 77.58
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1043.99
ACD/KOC (pH 7.4): 3683.55
Polar Surface Area: 17 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 34.4±7.0 dyne/cm
Molar Volume: 373.6±7.0 cm3

Click to predict properties on the Chemicalize site


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