ChemSpider 2D Image | 2,2'-(6,13-Pentacenediyl)dithiophene | C30H18S2

2,2'-(6,13-Pentacenediyl)dithiophene

  • Molecular FormulaC30H18S2
  • Average mass442.594 Da
  • Monoisotopic mass442.084991 Da
  • ChemSpider ID28580083

More details:

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

2,2'-(6,13-Pentacendiyl)dithiophen [German] [ACD/IUPAC Name]
2,2'-(6,13-Pentacenediyl)dithiophene [ACD/IUPAC Name]
2,2'-(6,13-Pentacènediyl)dithiophène [French] [ACD/IUPAC Name]
Thiophene, 2,2'-(6,13-pentacenediyl)bis- [ACD/Index Name]
2,2'-(Pentacene-6,13-diyl)dithiophene
2-[13-(THIOPHEN-2-YL)PENTACEN-6-YL]THIOPHENE
6,13-Bis(2-thienyl)pentacene
6,13-Di(thiophen-2-yl)pentacene
849466-79-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 615.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 248.6±16.3 °C
Index of Refraction: 1.801
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 10.27
ACD/LogD (pH 5.5): 9.37
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2973432.00
ACD/LogD (pH 7.4): 9.37
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2973432.00
Polar Surface Area: 56 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 60.5±3.0 dyne/cm
Molar Volume: 335.4±3.0 cm3

Click to predict properties on the Chemicalize site


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