ChemSpider 2D Image | Methyl 1-{[(4,4-difluorocyclohexyl)carbonyl]amino}cyclopropanecarboxylate | C12H17F2NO3

Methyl 1-{[(4,4-difluorocyclohexyl)carbonyl]amino}cyclopropanecarboxylate

  • Molecular FormulaC12H17F2NO3
  • Average mass261.265 Da
  • Monoisotopic mass261.117645 Da
  • ChemSpider ID67995575

More details:

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

1-{[(4,4-Difluorocyclohexyl)carbonyl]amino}cyclopropanecarboxylate de méthyle [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 1-[[(4,4-difluorocyclohexyl)carbonyl]amino]-, methyl ester [ACD/Index Name]
Methyl 1-{[(4,4-difluorocyclohexyl)carbonyl]amino}cyclopropanecarboxylate [ACD/IUPAC Name]
Methyl-1-{[(4,4-difluorcyclohexyl)carbonyl]amino}cyclopropancarboxylat [German] [ACD/IUPAC 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: 388.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 188.4±27.9 °C
Index of Refraction: 1.480
Molar Refractivity: 59.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.04
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 2.58
ACD/KOC (pH 5.5): 68.61
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.58
ACD/KOC (pH 7.4): 68.61
Polar Surface Area: 55 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 38.1±5.0 dyne/cm
Molar Volume: 209.1±5.0 cm3

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