ChemSpider 2D Image | 3-(1-Azepanyl)-1-(4-butoxyphenyl)-1-(4-methylphenyl)-2-phenyl-1-propanol | C32H41NO2

3-(1-Azepanyl)-1-(4-butoxyphenyl)-1-(4-methylphenyl)-2-phenyl-1-propanol

  • Molecular FormulaC32H41NO2
  • Average mass471.673 Da
  • Monoisotopic mass471.313721 Da
  • ChemSpider ID21598057

More details:






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

1H-Azepine-1-propanol, α-(4-butoxyphenyl)hexahydro-α-(4-methylphenyl)-β-phenyl- [ACD/Index Name]
3-(1-Azepanyl)-1-(4-butoxyphenyl)-1-(4-methylphenyl)-2-phenyl-1-propanol [ACD/IUPAC Name]
3-(1-Azepanyl)-1-(4-butoxyphenyl)-1-(4-methylphenyl)-2-phenyl-1-propanol [German] [ACD/IUPAC Name]
3-(1-Azépanyl)-1-(4-butoxyphényl)-1-(4-méthylphényl)-2-phényl-1-propanol [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 611.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.5±3.0 kJ/mol
Flash Point: 323.7±31.5 °C
Index of Refraction: 1.569
Molar Refractivity: 145.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 7.96
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 126.30
ACD/KOC (pH 5.5): 153.65
ACD/LogD (pH 7.4): 5.15
ACD/BCF (pH 7.4): 1711.38
ACD/KOC (pH 7.4): 2082.08
Polar Surface Area: 33 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 442.7±3.0 cm3

Click to predict properties on the Chemicalize site






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