ChemSpider 2D Image | 3-({[2-(4-Bromo-2,5-dimethoxyphenyl)ethyl]amino}methyl)phenol | C17H20BrNO3

3-({[2-(4-Bromo-2,5-dimethoxyphenyl)ethyl]amino}methyl)phenol

  • Molecular FormulaC17H20BrNO3
  • Average mass366.250 Da
  • Monoisotopic mass365.062653 Da
  • ChemSpider ID58977714

More details:

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

3-({[2-(4-Brom-2,5-dimethoxyphenyl)ethyl]amino}methyl)phenol [German] [ACD/IUPAC Name]
3-({[2-(4-Bromo-2,5-dimethoxyphenyl)ethyl]amino}methyl)phenol [ACD/IUPAC Name]
3-({[2-(4-Bromo-2,5-diméthoxyphényl)éthyl]amino}méthyl)phénol [French] [ACD/IUPAC Name]
Phenol, 3-[[[2-(4-bromo-2,5-dimethoxyphenyl)ethyl]amino]methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 490.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.6±3.0 kJ/mol
Flash Point: 250.7±27.3 °C
Index of Refraction: 1.590
Molar Refractivity: 91.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.06
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 21.49
ACD/KOC (pH 7.4): 126.68
Polar Surface Area: 51 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 270.9±3.0 cm3

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