ChemSpider 2D Image | Thieno[3,2-e][1]benzothiophene-4,5-dione | C10H4O2S2

Thieno[3,2-e][1]benzothiophene-4,5-dione

  • Molecular FormulaC10H4O2S2
  • Average mass220.268 Da
  • Monoisotopic mass219.965271 Da
  • ChemSpider ID23299263

More details:

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

benzo[1,2-b:4,3-b']bisthiophene-4,5-dione
Benzo[1,2-b:4,3-b']dithiophene-4,5-dione [ACD/Index Name]
Thieno[3,2-e][1]benzothiophen-4,5-dion [German] [ACD/IUPAC Name]
Thieno[3,2-e][1]benzothiophene-4,5-dione [ACD/IUPAC Name]
Thiéno[3,2-e][1]benzothiophène-4,5-dione [French] [ACD/IUPAC Name]
24243-31-0 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL398109/
MFCD20488814

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

Density: 1.6±0.1 g/cm3
Boiling Point: 422.8±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 209.5±21.8 °C
Index of Refraction: 1.736
Molar Refractivity: 55.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 52.36
ACD/KOC (pH 5.5): 591.63
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 52.36
ACD/KOC (pH 7.4): 591.63
Polar Surface Area: 91 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 73.8±3.0 dyne/cm
Molar Volume: 138.0±3.0 cm3

Click to predict properties on the Chemicalize site


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