ChemSpider 2D Image | 2-(4-Methoxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone | C16H15F3O3

2-(4-Methoxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone

  • Molecular FormulaC16H15F3O3
  • Average mass312.284 Da
  • Monoisotopic mass312.097321 Da
  • ChemSpider ID32783478

More details:

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

2-(4-Methoxybenzyliden)-6-(2,2,2-trifluor-1-hydroxyethyliden)cyclohexanon [German] [ACD/IUPAC Name]
2-(4-Methoxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone [ACD/IUPAC Name]
2-(4-Méthoxybenzylidène)-6-(2,2,2-trifluoro-1-hydroxyéthylidène)cyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 2-[(4-methoxyphenyl)methylene]-6-(2,2,2-trifluoro-1-hydroxyethylidene)- [ACD/Index 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: 466.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 235.9±28.7 °C
Index of Refraction: 1.563
Molar Refractivity: 76.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.01
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 921.79
ACD/KOC (pH 5.5): 4609.03
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 880.70
ACD/KOC (pH 7.4): 4403.61
Polar Surface Area: 47 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 234.0±3.0 cm3

Click to predict properties on the Chemicalize site


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