ChemSpider 2D Image | (2E)-N-{(1S)-1-(2,6-Dichlorophenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-2,3-diphenyl-N-propylacrylamide | C30H32Cl2N2O2

(2E)-N-{(1S)-1-(2,6-Dichlorophenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-2,3-diphenyl-N-propylacrylamide

  • Molecular FormulaC30H32Cl2N2O2
  • Average mass523.493 Da
  • Monoisotopic mass522.184082 Da
  • ChemSpider ID62424307

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2E)-N-{(1S)-1-(2,6-Dichlorophenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-2,3-diphenyl-N-propylacrylamide [ACD/IUPAC Name]
(2E)-N-{(1S)-1-(2,6-Dichlorophényl)-2-[(2-méthyl-2-propanyl)amino]-2-oxoéthyl}-2,3-diphényl-N-propylacrylamide [French] [ACD/IUPAC Name]
(2E)-N-{(1S)-1-(2,6-Dichlorphenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-2,3-diphenyl-N-propylacrylamid [German] [ACD/IUPAC Name]
Benzeneacetamide, 2,6-dichloro-N-(1,1-dimethylethyl)-α-[[(2E)-1-oxo-2,3-diphenyl-2-propen-1-yl]propylamino]-, (αS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 700.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 377.3±32.9 °C
Index of Refraction: 1.604
Molar Refractivity: 150.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.99
ACD/LogD (pH 5.5): 6.87
ACD/BCF (pH 5.5): 97800.63
ACD/KOC (pH 5.5): 129916.88
ACD/LogD (pH 7.4): 6.87
ACD/BCF (pH 7.4): 97800.63
ACD/KOC (pH 7.4): 129916.88
Polar Surface Area: 49 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 436.8±3.0 cm3

Click to predict properties on the Chemicalize site


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