ChemSpider 2D Image | 4-[(Cyclobutylmethyl)(2,2,2-trifluoroethyl)carbamoyl]benzoic acid | C15H16F3NO3

4-[(Cyclobutylmethyl)(2,2,2-trifluoroethyl)carbamoyl]benzoic acid

  • Molecular FormulaC15H16F3NO3
  • Average mass315.288 Da
  • Monoisotopic mass315.108215 Da
  • ChemSpider ID30416169

More details:

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

4-[(Cyclobutylmethyl)(2,2,2-trifluorethyl)carbamoyl]benzoesäure [German] [ACD/IUPAC Name]
4-[(Cyclobutylmethyl)(2,2,2-trifluoroethyl)carbamoyl]benzoic acid [ACD/IUPAC Name]
Acide 4-[(cyclobutylméthyl)(2,2,2-trifluoroéthyl)carbamoyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(cyclobutylmethyl)(2,2,2-trifluoroethyl)amino]carbonyl]- [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: 445.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 223.0±28.7 °C
Index of Refraction: 1.529
Molar Refractivity: 73.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 4.64
ACD/KOC (pH 5.5): 35.27
ACD/LogD (pH 7.4): 0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.57
Polar Surface Area: 58 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 237.2±3.0 cm3

Click to predict properties on the Chemicalize site


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