ChemSpider 2D Image | 2-(4-Bromo-2,5-dimethoxyphenyl)-N-(2-fluorobenzyl)ethanamine | C17H19BrFNO2

2-(4-Bromo-2,5-dimethoxyphenyl)-N-(2-fluorobenzyl)ethanamine

  • Molecular FormulaC17H19BrFNO2
  • Average mass368.241 Da
  • Monoisotopic mass367.058319 Da
  • ChemSpider ID95755414

More details:

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

2-(4-Brom-2,5-dimethoxyphenyl)-N-(2-fluorbenzyl)ethanamin [German] [ACD/IUPAC Name]
2-(4-Bromo-2,5-dimethoxyphenyl)-N-(2-fluorobenzyl)ethanamine [ACD/IUPAC Name]
2-(4-Bromo-2,5-diméthoxyphényl)-N-(2-fluorobenzyl)éthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 4-bromo-N-[(2-fluorophenyl)methyl]-2,5-dimethoxy- [ACD/Index 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: 439.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 219.4±27.3 °C
Index of Refraction: 1.561
Molar Refractivity: 89.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 1.95
ACD/BCF (pH 5.5): 4.26
ACD/KOC (pH 5.5): 18.15
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 207.67
ACD/KOC (pH 7.4): 885.19
Polar Surface Area: 30 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 276.7±3.0 cm3

Click to predict properties on the Chemicalize site


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