ChemSpider 2D Image | 4-[Cyclobutyl(3,3,3-trifluoropropyl)carbamoyl]benzoic acid | C15H16F3NO3

4-[Cyclobutyl(3,3,3-trifluoropropyl)carbamoyl]benzoic acid

  • Molecular FormulaC15H16F3NO3
  • Average mass315.288 Da
  • Monoisotopic mass315.108215 Da
  • ChemSpider ID30416170

More details:

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

4-[Cyclobutyl(3,3,3-trifluoropropyl)carbamoyl]benzoic acid [ACD/IUPAC Name]
4-[Cyclobutyl(3,3,3-trifluorpropyl)carbamoyl]benzoesäure [German] [ACD/IUPAC Name]
Acide 4-[cyclobutyl(3,3,3-trifluoropropyl)carbamoyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[cyclobutyl(3,3,3-trifluoropropyl)amino]carbonyl]- [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: 447.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 224.5±28.7 °C
Index of Refraction: 1.534
Molar Refractivity: 72.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 4.22
ACD/KOC (pH 5.5): 34.37
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.39
Polar Surface Area: 58 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 232.7±5.0 cm3

Click to predict properties on the Chemicalize site


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