ChemSpider 2D Image | 4,4′-bis(mercaptomethyl)benzophenone | C15H14OS2

4,4′-bis(mercaptomethyl)benzophenone

  • Molecular FormulaC15H14OS2
  • Average mass274.401 Da
  • Monoisotopic mass274.048615 Da
  • ChemSpider ID24771667

More details:

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

4,4′-bis(mercaptomethyl)benzophenone
Bis[4-(sulfanylmethyl)phenyl]methanon [German] [ACD/IUPAC Name]
Bis[4-(sulfanylmethyl)phenyl]methanone [ACD/IUPAC Name]
Bis[4-(sulfanylméthyl)phényl]méthanone [French] [ACD/IUPAC Name]
Methanone, bis[4-(mercaptomethyl)phenyl]- [ACD/Index Name]
58931-68-3 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 460.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.0±27.3 °C
Index of Refraction: 1.634
Molar Refractivity: 81.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 530.98
ACD/KOC (pH 5.5): 3105.58
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 506.86
ACD/KOC (pH 7.4): 2964.51
Polar Surface Area: 95 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 228.3±3.0 cm3

Click to predict properties on the Chemicalize site


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