ChemSpider 2D Image | Methyl (2E)-2-({(2-formylphenyl)[(4-methylphenyl)sulfonyl]amino}methyl)-3-phenylacrylate | C25H23NO5S

Methyl (2E)-2-({(2-formylphenyl)[(4-methylphenyl)sulfonyl]amino}methyl)-3-phenylacrylate

  • Molecular FormulaC25H23NO5S
  • Average mass449.519 Da
  • Monoisotopic mass449.129700 Da
  • ChemSpider ID30657198

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-({(2-Formylphényl)[(4-méthylphényl)sulfonyl]amino}méthyl)-3-phénylacrylate de méthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 2-[[(2-formylphenyl)[(4-methylphenyl)sulfonyl]amino]methyl]-3-phenyl-, methyl ester, (2E)- [ACD/Index Name]
Methyl (2E)-2-({(2-formylphenyl)[(4-methylphenyl)sulfonyl]amino}methyl)-3-phenylacrylate [ACD/IUPAC Name]
Methyl-(2E)-2-({(2-formylphenyl)[(4-methylphenyl)sulfonyl]amino}methyl)-3-phenylacrylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 633.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.6±3.0 kJ/mol
Flash Point: 336.8±34.3 °C
Index of Refraction: 1.629
Molar Refractivity: 123.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1026.37
ACD/KOC (pH 5.5): 4978.43
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1026.37
ACD/KOC (pH 7.4): 4978.43
Polar Surface Area: 89 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 346.7±3.0 cm3

Click to predict properties on the Chemicalize site


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