ChemSpider 2D Image | 3-Methylthieno[3,2-b]thiophen-2(3H)-one | C7H6OS2

3-Methylthieno[3,2-b]thiophen-2(3H)-one

  • Molecular FormulaC7H6OS2
  • Average mass170.252 Da
  • Monoisotopic mass169.986008 Da
  • ChemSpider ID74141064

More details:

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

3-Methylthieno[3,2-b]thiophen-2(3H)-on [German] [ACD/IUPAC Name]
3-Methylthieno[3,2-b]thiophen-2(3H)-one [ACD/IUPAC Name]
3-Méthylthiéno[3,2-b]thiophén-2(3H)-one [French] [ACD/IUPAC Name]
Thieno[3,2-b]thiophen-2(3H)-one, 3-methyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 235.7±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.3±3.0 kJ/mol
Flash Point: 96.4±24.3 °C
Index of Refraction: 1.650
Molar Refractivity: 45.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.15
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.96
ACD/KOC (pH 5.5): 513.52
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.96
ACD/KOC (pH 7.4): 513.52
Polar Surface Area: 71 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 124.0±3.0 cm3

Click to predict properties on the Chemicalize site


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