ChemSpider 2D Image | 3-Ethyl-1-(2-phenylethyl)-8-[2-(trifluoromethyl)benzyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione | C25H28F3N3O2

3-Ethyl-1-(2-phenylethyl)-8-[2-(trifluoromethyl)benzyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione

  • Molecular FormulaC25H28F3N3O2
  • Average mass459.504 Da
  • Monoisotopic mass459.213348 Da
  • ChemSpider ID22249927

More details:

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

1,3,8-Triazaspiro[4.5]decane-2,4-dione, 3-ethyl-1-(2-phenylethyl)-8-[[2-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
3-Ethyl-1-(2-phenylethyl)-8-[2-(trifluormethyl)benzyl]-1,3,8-triazaspiro[4.5]decan-2,4-dion [German] [ACD/IUPAC Name]
3-Ethyl-1-(2-phenylethyl)-8-[2-(trifluoromethyl)benzyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione [ACD/IUPAC Name]
3-Éthyl-1-(2-phényléthyl)-8-[2-(trifluorométhyl)benzyl]-1,3,8-triazaspiro[4.5]décane-2,4-dione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 522.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 270.0±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 119.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 6.64
ACD/KOC (pH 5.5): 29.91
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 334.73
ACD/KOC (pH 7.4): 1507.63
Polar Surface Area: 44 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 52.1±5.0 dyne/cm
Molar Volume: 352.5±5.0 cm3

Click to predict properties on the Chemicalize site


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