ChemSpider 2D Image | JW651 | C21H18Cl2F6N2O2

JW651

  • Molecular FormulaC21H18Cl2F6N2O2
  • Average mass515.276 Da
  • Monoisotopic mass514.064941 Da
  • ChemSpider ID49073787

More details:

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

1,1,1,3,3,3-Hexafluor-2-propanyl-4-[bis(4-chlorphenyl)methyl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
1,1,1,3,3,3-Hexafluoro-2-propanyl 4-[bis(4-chlorophenyl)methyl]-1-piperazinecarboxylate [ACD/IUPAC Name]
1,1,1,3,3,3-Hexafluoropropan-2-yl 4-(bis(4-chlorophenyl)methyl)piperazine-1-carboxylate
1-Piperazinecarboxylic acid, 4-[bis(4-chlorophenyl)methyl]-, 2,2,2-trifluoro-1-(trifluoromethyl)ethyl ester [ACD/Index Name]
4-[Bis(4-chlorophényl)méthyl]-1-pipérazinecarboxylate de 1,1,1,3,3,3-hexafluoro-2-propanyle [French] [ACD/IUPAC Name]
JW651
MFCD28137685

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 460.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.4±28.7 °C
Index of Refraction: 1.526
Molar Refractivity: 110.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 6.27
ACD/BCF (pH 5.5): 31388.45
ACD/KOC (pH 5.5): 52027.71
ACD/LogD (pH 7.4): 6.42
ACD/BCF (pH 7.4): 44639.84
ACD/KOC (pH 7.4): 73992.44
Polar Surface Area: 33 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 358.4±3.0 cm3

Click to predict properties on the Chemicalize site


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