ChemSpider 2D Image | 2-(4-Bromo-2,5-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine | C17H21BrN2O3

2-(4-Bromo-2,5-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine

  • Molecular FormulaC17H21BrN2O3
  • Average mass381.264 Da
  • Monoisotopic mass380.073547 Da
  • ChemSpider ID58976150

More details:

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

2-(4-Brom-2,5-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamin [German] [ACD/IUPAC Name]
2-(4-Bromo-2,5-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine [ACD/IUPAC Name]
2-(4-Bromo-2,5-diméthoxyphényl)-N-[(2-méthoxy-3-pyridinyl)méthyl]éthanamine [French] [ACD/IUPAC Name]
3-Pyridinemethanamine, N-[2-(4-bromo-2,5-dimethoxyphenyl)ethyl]-2-methoxy- [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: 468.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.0±3.0 kJ/mol
Flash Point: 236.9±27.3 °C
Index of Refraction: 1.565
Molar Refractivity: 94.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 5.53
ACD/KOC (pH 5.5): 38.50
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 172.71
ACD/KOC (pH 7.4): 1201.54
Polar Surface Area: 53 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 289.7±3.0 cm3

Click to predict properties on the Chemicalize site


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