ChemSpider 2D Image | 3-Iodophenyl (E)-2-phenylethenesulfonate | C14H11IO3S

3-Iodophenyl (E)-2-phenylethenesulfonate

  • Molecular FormulaC14H11IO3S
  • Average mass386.205 Da
  • Monoisotopic mass385.947357 Da
  • ChemSpider ID31279121

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-2-Phényléthènesulfonate de 3-iodophényle [French] [ACD/IUPAC Name]
3-Iodophenyl (E)-2-phenylethenesulfonate [ACD/IUPAC Name]
3-Iodphenyl-(E)-2-phenylethensulfonat [German] [ACD/IUPAC Name]
Ethenesulfonic acid, 2-phenyl-, 3-iodophenyl ester, (E)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 404.7±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 198.6±26.8 °C
Index of Refraction: 1.669
Molar Refractivity: 84.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1422.70
ACD/KOC (pH 5.5): 6289.23
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1422.70
ACD/KOC (pH 7.4): 6289.23
Polar Surface Area: 52 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 225.4±3.0 cm3

Click to predict properties on the Chemicalize site


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