ChemSpider 2D Image | 4,8-Bis(hexyloxy)benzo[1,2-b:4,5-b']dithiophene | C22H30O2S2

4,8-Bis(hexyloxy)benzo[1,2-b:4,5-b']dithiophene

  • Molecular FormulaC22H30O2S2
  • Average mass390.602 Da
  • Monoisotopic mass390.168732 Da
  • ChemSpider ID29211661

More details:

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

359017-55-3 [RN]
4,8-Bis(hexyloxy)benzo[1,2-b:4,5-b']dithiophene
4,8-Bis(hexyloxy)thieno[2,3-f][1]benzothiophen [German] [ACD/IUPAC Name]
4,8-Bis(hexyloxy)thieno[2,3-f][1]benzothiophene [ACD/IUPAC Name]
4,8-Bis(hexyloxy)thiéno[2,3-f][1]benzothiophène [French] [ACD/IUPAC Name]
Benzo[1,2-b:4,5-b']dithiophene, 4,8-bis(hexyloxy)- [ACD/Index Name]
4,8-Bis(hexyloxy)benzo[1,2-b:4,5-b']bisthiophene

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

Density: 1.1±0.1 g/cm3
Boiling Point: 522.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 269.7±28.7 °C
Index of Refraction: 1.592
Molar Refractivity: 118.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 11.69
ACD/LogD (pH 5.5): 8.77
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1400002.00
ACD/LogD (pH 7.4): 8.77
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1400002.00
Polar Surface Area: 75 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 349.7±3.0 cm3

Click to predict properties on the Chemicalize site


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