ChemSpider 2D Image | 6-(4-Oxo-4-phenylbutanoyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide | C26H27F3N2O3

6-(4-Oxo-4-phenylbutanoyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide

  • Molecular FormulaC26H27F3N2O3
  • Average mass472.499 Da
  • Monoisotopic mass472.197388 Da
  • ChemSpider ID22223357

More details:

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

6-(4-Oxo-4-phenylbutanoyl)-N-[2-(trifluormethyl)benzyl]-6-azaspiro[2.5]octan-1-carboxamid [German] [ACD/IUPAC Name]
6-(4-Oxo-4-phenylbutanoyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [ACD/IUPAC Name]
6-(4-Oxo-4-phénylbutanoyl)-N-[2-(trifluorométhyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [French] [ACD/IUPAC Name]
6-Azaspiro[2.5]octane-1-carboxamide, 6-(1,4-dioxo-4-phenylbutyl)-N-[[2-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
6-(4-OXO-4-PHENYLBUTANOYL)-N-{[2-(TRIFLUOROMETHYL)PHENYL]METHYL}-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: 674.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.0±3.0 kJ/mol
Flash Point: 361.5±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 120.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 292.71
ACD/KOC (pH 5.5): 2028.06
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 292.71
ACD/KOC (pH 7.4): 2028.06
Polar Surface Area: 66 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 51.3±5.0 dyne/cm
Molar Volume: 360.9±5.0 cm3

Click to predict properties on the Chemicalize site


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