ChemSpider 2D Image | (2E)-N-{3-[(1-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-1-oxo-2-propanyl)oxy]phenyl}-3-(4-methylphenyl)acrylamide | C26H22ClF3N2O3

(2E)-N-{3-[(1-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-1-oxo-2-propanyl)oxy]phenyl}-3-(4-methylphenyl)acrylamide

  • Molecular FormulaC26H22ClF3N2O3
  • Average mass502.913 Da
  • Monoisotopic mass502.127106 Da
  • ChemSpider ID67293542

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-{3-[(1-{[2-Chlor-5-(trifluormethyl)phenyl]amino}-1-oxo-2-propanyl)oxy]phenyl}-3-(4-methylphenyl)acrylamid [German] [ACD/IUPAC Name]
(2E)-N-{3-[(1-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-1-oxo-2-propanyl)oxy]phenyl}-3-(4-methylphenyl)acrylamide [ACD/IUPAC Name]
(2E)-N-{3-[(1-{[2-Chloro-5-(trifluorométhyl)phényl]amino}-1-oxo-2-propanyl)oxy]phényl}-3-(4-méthylphényl)acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, N-[3-[2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-1-methyl-2-oxoethoxy]phenyl]-3-(4-methylphenyl)-, (2E)- [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: 683.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.4±31.5 °C
Index of Refraction: 1.624
Molar Refractivity: 131.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.78
ACD/LogD (pH 5.5): 6.05
ACD/BCF (pH 5.5): 23431.42
ACD/KOC (pH 5.5): 46718.30
ACD/LogD (pH 7.4): 6.05
ACD/BCF (pH 7.4): 23430.78
ACD/KOC (pH 7.4): 46717.02
Polar Surface Area: 67 Å2
Polarizability: 52.0±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 371.5±3.0 cm3

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