ChemSpider 2D Image | 6-(Adamantan-1-ylcarbonyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide | C27H33F3N2O2

6-(Adamantan-1-ylcarbonyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide

  • Molecular FormulaC27H33F3N2O2
  • Average mass474.558 Da
  • Monoisotopic mass474.249420 Da
  • ChemSpider ID22149368

More details:

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

6-(Adamantan-1-ylcarbonyl)-N-[2-(trifluormethyl)benzyl]-6-azaspiro[2.5]octan-1-carboxamid [German] [ACD/IUPAC Name]
6-(Adamantan-1-ylcarbonyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [ACD/IUPAC Name]
6-(Adamantan-1-ylcarbonyl)-N-[2-(trifluorométhyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [French] [ACD/IUPAC Name]
6-Azaspiro[2.5]octane-1-carboxamide, 6-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)-N-[[2-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
6-(1-adamantylcarbonyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 638.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.3±3.0 kJ/mol
Flash Point: 340.0±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 121.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1552.96
ACD/KOC (pH 5.5): 6696.22
ACD/LogD (pH 7.4): 4.50
ACD/BCF (pH 7.4): 1552.96
ACD/KOC (pH 7.4): 6696.23
Polar Surface Area: 49 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 364.2±5.0 cm3

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