ChemSpider 2D Image | 1-Benzyl-3-(2-methoxyethyl)-8-[4-(trifluoromethyl)benzyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione | C25H28F3N3O3

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

  • Molecular FormulaC25H28F3N3O3
  • Average mass475.503 Da
  • Monoisotopic mass475.208282 Da
  • ChemSpider ID22162752

More details:

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

1,3,8-Triazaspiro[4.5]decane-2,4-dione, 3-(2-methoxyethyl)-1-(phenylmethyl)-8-[[4-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
1-Benzyl-3-(2-methoxyethyl)-8-[4-(trifluormethyl)benzyl]-1,3,8-triazaspiro[4.5]decan-2,4-dion [German] [ACD/IUPAC Name]
1-Benzyl-3-(2-methoxyethyl)-8-[4-(trifluoromethyl)benzyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione [ACD/IUPAC Name]
1-Benzyl-3-(2-méthoxyéthyl)-8-[4-(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: 543.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 282.6±32.9 °C
Index of Refraction: 1.594
Molar Refractivity: 121.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 3.29
ACD/KOC (pH 5.5): 18.35
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 165.09
ACD/KOC (pH 7.4): 919.75
Polar Surface Area: 53 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 53.0±5.0 dyne/cm
Molar Volume: 358.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement