ChemSpider 2D Image | (2Z)-N-[4-Chloro-3-(trifluoromethyl)phenyl]-2-cyano-3-[(2-methoxy-5-nitrophenyl)amino]acrylamide | C18H12ClF3N4O4

(2Z)-N-[4-Chloro-3-(trifluoromethyl)phenyl]-2-cyano-3-[(2-methoxy-5-nitrophenyl)amino]acrylamide

  • Molecular FormulaC18H12ClF3N4O4
  • Average mass440.760 Da
  • Monoisotopic mass440.049927 Da
  • ChemSpider ID34688852

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-N-[4-Chlor-3-(trifluormethyl)phenyl]-2-cyan-3-[(2-methoxy-5-nitrophenyl)amino]acrylamid [German] [ACD/IUPAC Name]
(2Z)-N-[4-Chloro-3-(trifluoromethyl)phenyl]-2-cyano-3-[(2-methoxy-5-nitrophenyl)amino]acrylamide [ACD/IUPAC Name]
(2Z)-N-[4-Chloro-3-(trifluorométhyl)phényl]-2-cyano-3-[(2-méthoxy-5-nitrophényl)amino]acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-cyano-3-[(2-methoxy-5-nitrophenyl)amino]-, (2Z)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 590.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 311.1±30.1 °C
Index of Refraction: 1.627
Molar Refractivity: 101.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.22
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1596.67
ACD/KOC (pH 5.5): 6830.33
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1579.71
ACD/KOC (pH 7.4): 6757.81
Polar Surface Area: 120 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 287.5±3.0 cm3

Click to predict properties on the Chemicalize site


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