ChemSpider 2D Image | (2E)-4-Fluoro-1,3-diphenyl-4,4-bis(phenylsulfonyl)-2-buten-1-one | C28H21FO5S2

(2E)-4-Fluoro-1,3-diphenyl-4,4-bis(phenylsulfonyl)-2-buten-1-one

  • Molecular FormulaC28H21FO5S2
  • Average mass520.592 Da
  • Monoisotopic mass520.081421 Da
  • ChemSpider ID30658705

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-4-Fluor-1,3-diphenyl-4,4-bis(phenylsulfonyl)-2-buten-1-on [German] [ACD/IUPAC Name]
(2E)-4-Fluoro-1,3-diphenyl-4,4-bis(phenylsulfonyl)-2-buten-1-one [ACD/IUPAC Name]
(2E)-4-Fluoro-1,3-diphényl-4,4-bis(phénylsulfonyl)-2-butén-1-one [French] [ACD/IUPAC Name]
2-Buten-1-one, 4-fluoro-1,3-diphenyl-4,4-bis(phenylsulfonyl)-, (2E)- [ACD/Index 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: 762.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.1±3.0 kJ/mol
Flash Point: 415.0±32.9 °C
Index of Refraction: 1.625
Molar Refractivity: 137.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 8.91
ACD/LogD (pH 5.5): 6.24
ACD/BCF (pH 5.5): 32235.41
ACD/KOC (pH 5.5): 58701.49
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 32235.41
ACD/KOC (pH 7.4): 58701.49
Polar Surface Area: 102 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 387.5±3.0 cm3

Click to predict properties on the Chemicalize site


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