ChemSpider 2D Image | 3,3'-(1,2-Phenylene)bis(2-methyl-5-phenylthiophene) | C28H22S2

3,3'-(1,2-Phenylene)bis(2-methyl-5-phenylthiophene)

  • Molecular FormulaC28H22S2
  • Average mass422.604 Da
  • Monoisotopic mass422.116302 Da
  • ChemSpider ID24743762

More details:

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

3,3'-(1,2-Phenylen)bis(2-methyl-5-phenylthiophen) [German] [ACD/IUPAC Name]
3,3'-(1,2-Phenylene)bis(2-methyl-5-phenylthiophene) [ACD/IUPAC Name]
3,3'-(1,2-Phénylène)bis(2-méthyl-5-phénylthiophène) [French] [ACD/IUPAC Name]
Thiophene, 3,3'-(1,2-phenylene)bis[2-methyl-5-phenyl- [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: 469.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 179.8±13.5 °C
Index of Refraction: 1.644
Molar Refractivity: 131.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 9.89
ACD/LogD (pH 5.5): 8.33
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 806513.13
ACD/LogD (pH 7.4): 8.33
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 806513.13
Polar Surface Area: 56 Å2
Polarizability: 51.9±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 362.1±3.0 cm3

Click to predict properties on the Chemicalize site


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