ChemSpider 2D Image | 2-[(Cyclobutylmethyl)(2,2,2-trifluoroethyl)carbamoyl]cyclopropanecarboxylic acid | C12H16F3NO3

2-[(Cyclobutylmethyl)(2,2,2-trifluoroethyl)carbamoyl]cyclopropanecarboxylic acid

  • Molecular FormulaC12H16F3NO3
  • Average mass279.255 Da
  • Monoisotopic mass279.108215 Da
  • ChemSpider ID62238732

More details:

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

2-[(Cyclobutylmethyl)(2,2,2-trifluorethyl)carbamoyl]cyclopropancarbonsäure [German] [ACD/IUPAC Name]
2-[(Cyclobutylmethyl)(2,2,2-trifluoroethyl)carbamoyl]cyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide 2-[(cyclobutylméthyl)(2,2,2-trifluoroéthyl)carbamoyl]cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2-[[(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: 1.4±0.1 g/cm3
Boiling Point: 390.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.3±6.0 kJ/mol
Flash Point: 190.2±27.9 °C
Index of Refraction: 1.501
Molar Refractivity: 59.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.25
ACD/LogD (pH 5.5): 0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.78
ACD/LogD (pH 7.4): -1.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 200.4±3.0 cm3

Click to predict properties on the Chemicalize site


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