ChemSpider 2D Image | Ethyl {3-[methyl(2-oxo-2-{[4-(trifluoromethoxy)phenyl]amino}ethyl)carbamoyl]phenyl}carbamate | C20H20F3N3O5

Ethyl {3-[methyl(2-oxo-2-{[4-(trifluoromethoxy)phenyl]amino}ethyl)carbamoyl]phenyl}carbamate

  • Molecular FormulaC20H20F3N3O5
  • Average mass439.385 Da
  • Monoisotopic mass439.135498 Da
  • ChemSpider ID22058715

More details:

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

{3-[Méthyl(2-oxo-2-{[4-(trifluorométhoxy)phényl]amino}éthyl)carbamoyl]phényl}carbamate d'éthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[3-[[methyl[2-oxo-2-[[4-(trifluoromethoxy)phenyl]amino]ethyl]amino]carbonyl]phenyl]-, ethyl ester [ACD/Index Name]
Ethyl {3-[methyl(2-oxo-2-{[4-(trifluoromethoxy)phenyl]amino}ethyl)carbamoyl]phenyl}carbamate [ACD/IUPAC Name]
Ethyl-{3-[methyl(2-oxo-2-{[4-(trifluormethoxy)phenyl]amino}ethyl)carbamoyl]phenyl}carbamat [German] [ACD/IUPAC Name]
ETHYL N-{3-[METHYL({[4-(TRIFLUOROMETHOXY)PHENYL]CARBAMOYL}METHYL)CARBAMOYL]PHENYL}CARBAMATE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 564.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 294.9±30.1 °C
Index of Refraction: 1.582
Molar Refractivity: 106.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 73.06
ACD/KOC (pH 5.5): 750.97
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.06
ACD/KOC (pH 7.4): 750.95
Polar Surface Area: 97 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 318.5±3.0 cm3

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