ChemSpider 2D Image | 4-(1-Azepanyl)-2-(4-butoxyphenyl)-1,3-diphenyl-2-butanol | C32H41NO2

4-(1-Azepanyl)-2-(4-butoxyphenyl)-1,3-diphenyl-2-butanol

  • Molecular FormulaC32H41NO2
  • Average mass471.673 Da
  • Monoisotopic mass471.313721 Da
  • ChemSpider ID21598054

More details:






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

1H-Azepine-1-propanol, α-(4-butoxyphenyl)hexahydro-β-phenyl-α-(phenylmethyl)- [ACD/Index Name]
4-(1-Azepanyl)-2-(4-butoxyphenyl)-1,3-diphenyl-2-butanol [ACD/IUPAC Name]
4-(1-Azepanyl)-2-(4-butoxyphenyl)-1,3-diphenyl-2-butanol [German] [ACD/IUPAC Name]
4-(1-Azépanyl)-2-(4-butoxyphényl)-1,3-diphényl-2-butanol [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: 607.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 321.0±31.5 °C
Index of Refraction: 1.572
Molar Refractivity: 145.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.32
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 51.18
ACD/KOC (pH 5.5): 79.95
ACD/LogD (pH 7.4): 4.59
ACD/BCF (pH 7.4): 614.38
ACD/KOC (pH 7.4): 959.72
Polar Surface Area: 33 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 440.6±3.0 cm3

Click to predict properties on the Chemicalize site






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