ChemSpider 2D Image | 2-({3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol | C20H26BrNO3

2-({3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol

  • Molecular FormulaC20H26BrNO3
  • Average mass408.329 Da
  • Monoisotopic mass407.109589 Da
  • ChemSpider ID21536464

More details:

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

1-Butanol, 2-[[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]amino]- [ACD/Index Name]
2-({3-Brom-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol [German] [ACD/IUPAC Name]
2-({3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzyl}amino)-1-butanol [ACD/IUPAC Name]
2-({3-Bromo-5-méthoxy-4-[(4-méthylbenzyl)oxy]benzyl}amino)-1-butanol [French] [ACD/IUPAC Name]
2-[({3-BROMO-5-METHOXY-4-[(4-METHYLPHENYL)METHOXY]PHENYL}METHYL)AMINO]BUTAN-1-OL

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

Density: 1.3±0.1 g/cm3
Boiling Point: 522.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 269.9±28.7 °C
Index of Refraction: 1.572
Molar Refractivity: 105.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.54
ACD/LogD (pH 5.5): 2.32
ACD/BCF (pH 5.5): 8.86
ACD/KOC (pH 5.5): 33.54
ACD/LogD (pH 7.4): 4.03
ACD/BCF (pH 7.4): 451.41
ACD/KOC (pH 7.4): 1709.09
Polar Surface Area: 51 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 319.6±3.0 cm3

Click to predict properties on the Chemicalize site


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