ChemSpider 2D Image | N-{5-Bromo-2-[(4-methylbenzyl)oxy]benzyl}-1-hexanamine | C21H28BrNO

N-{5-Bromo-2-[(4-methylbenzyl)oxy]benzyl}-1-hexanamine

  • Molecular FormulaC21H28BrNO
  • Average mass390.357 Da
  • Monoisotopic mass389.135406 Da
  • ChemSpider ID21536269

More details:

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

Benzenemethanamine, 5-bromo-N-hexyl-2-[(4-methylphenyl)methoxy]- [ACD/Index Name]
N-{5-Brom-2-[(4-methylbenzyl)oxy]benzyl}-1-hexanamin [German] [ACD/IUPAC Name]
N-{5-Bromo-2-[(4-methylbenzyl)oxy]benzyl}-1-hexanamine [ACD/IUPAC Name]
N-{5-Bromo-2-[(4-méthylbenzyl)oxy]benzyl}-1-hexanamine [French] [ACD/IUPAC Name]
({5-BROMO-2-[(4-METHYLPHENYL)METHOXY]PHENYL}METHYL)(HEXYL)AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 468.2±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: 237.0±27.3 °C
Index of Refraction: 1.556
Molar Refractivity: 106.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 7.24
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 99.63
ACD/KOC (pH 5.5): 128.08
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 1068.51
ACD/KOC (pH 7.4): 1373.71
Polar Surface Area: 21 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 330.8±3.0 cm3

Click to predict properties on the Chemicalize site


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