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Search term: YELYILVXFIQAGP (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 2-[(2-Chloro-4-fluorophenyl)amino]-2-oxoethyl 1-[4-(trifluoromethyl)benzoyl]-4-piperidinecarboxylate | C22H19ClF4N2O4

2-[(2-Chloro-4-fluorophenyl)amino]-2-oxoethyl 1-[4-(trifluoromethyl)benzoyl]-4-piperidinecarboxylate

  • Molecular FormulaC22H19ClF4N2O4
  • Average mass486.844 Da
  • Monoisotopic mass486.096954 Da
  • ChemSpider ID70820151

More details:






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

1-[4-(Trifluorométhyl)benzoyl]-4-pipéridinecarboxylate de 2-[(2-chloro-4-fluorophényl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]
2-[(2-Chlor-4-fluorphenyl)amino]-2-oxoethyl-1-[4-(trifluormethyl)benzoyl]-4-piperidincarboxylat [German] [ACD/IUPAC Name]
2-[(2-Chloro-4-fluorophenyl)amino]-2-oxoethyl 1-[4-(trifluoromethyl)benzoyl]-4-piperidinecarboxylate [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[4-(trifluoromethyl)benzoyl]-, 2-[(2-chloro-4-fluorophenyl)amino]-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 617.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 327.4±31.5 °C
Index of Refraction: 1.568
Molar Refractivity: 110.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 432.13
ACD/KOC (pH 5.5): 2680.24
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 431.91
ACD/KOC (pH 7.4): 2678.90
Polar Surface Area: 76 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 339.3±3.0 cm3

Click to predict properties on the Chemicalize site






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