ChemSpider 2D Image | 4-[(4-Methylbenzoyl)amino]cyclohexyl 3,5-bis(trifluoromethyl)benzoate | C23H21F6NO3

4-[(4-Methylbenzoyl)amino]cyclohexyl 3,5-bis(trifluoromethyl)benzoate

  • Molecular FormulaC23H21F6NO3
  • Average mass473.408 Da
  • Monoisotopic mass473.142578 Da
  • ChemSpider ID59215331

More details:

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

3,5-Bis(trifluorométhyl)benzoate de 4-[(4-méthylbenzoyl)amino]cyclohexyle [French] [ACD/IUPAC Name]
4-[(4-Methylbenzoyl)amino]cyclohexyl 3,5-bis(trifluoromethyl)benzoate [ACD/IUPAC Name]
4-[(4-Methylbenzoyl)amino]cyclohexyl-3,5-bis(trifluormethyl)benzoat [German] [ACD/IUPAC Name]
Benzoic acid, 3,5-bis(trifluoromethyl)-, 4-[(4-methylbenzoyl)amino]cyclohexyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 520.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.4±30.1 °C
Index of Refraction: 1.524
Molar Refractivity: 106.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.98
ACD/LogD (pH 5.5): 6.30
ACD/BCF (pH 5.5): 35878.90
ACD/KOC (pH 5.5): 63377.86
ACD/LogD (pH 7.4): 6.30
ACD/BCF (pH 7.4): 35878.90
ACD/KOC (pH 7.4): 63377.86
Polar Surface Area: 55 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 41.6±5.0 dyne/cm
Molar Volume: 348.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement