ChemSpider 2D Image | 1-(1-Azepanyl)-4-[(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)oxy]-2-butanol | C20H37NO2

1-(1-Azepanyl)-4-[(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)oxy]-2-butanol

  • Molecular FormulaC20H37NO2
  • Average mass323.513 Da
  • Monoisotopic mass323.282440 Da
  • ChemSpider ID21663065

More details:

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

1-(1-Azepanyl)-4-[(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)oxy]-2-butanol [ACD/IUPAC Name]
1-(1-Azepanyl)-4-[(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)oxy]-2-butanol [German] [ACD/IUPAC Name]
1-(1-Azépanyl)-4-[(1,7,7-triméthylbicyclo[2.2.1]hept-2-yl)oxy]-2-butanol [French] [ACD/IUPAC Name]
1H-Azepine-1-ethanol, hexahydro-α-[2-[(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)oxy]ethyl]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 433.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.6±6.0 kJ/mol
Flash Point: 215.9±24.6 °C
Index of Refraction: 1.522
Molar Refractivity: 95.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 1.98
ACD/KOC (pH 5.5): 8.30
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 48.99
ACD/KOC (pH 7.4): 205.24
Polar Surface Area: 33 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 40.8±5.0 dyne/cm
Molar Volume: 313.8±5.0 cm3

Click to predict properties on the Chemicalize site


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