ChemSpider 2D Image | 4,6-Dihydrothieno[3,4-b]thiophene-2-carbonitrile | C7H5NS2

4,6-Dihydrothieno[3,4-b]thiophene-2-carbonitrile

  • Molecular FormulaC7H5NS2
  • Average mass167.251 Da
  • Monoisotopic mass166.986343 Da
  • ChemSpider ID122627237

More details:

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

4,6-Dihydrothieno[3,4-b]thiophen-2-carbonitril [German] [ACD/IUPAC Name]
4,6-Dihydrothieno[3,4-b]thiophene-2-carbonitrile [ACD/IUPAC Name]
4,6-Dihydrothiéno[3,4-b]thiophène-2-carbonitrile [French] [ACD/IUPAC Name]
Thieno[3,4-b]thiophene-2-carbonitrile, 4,6-dihydro- [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: 315.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 144.3±27.9 °C
Index of Refraction: 1.685
Molar Refractivity: 44.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 45.19
ACD/KOC (pH 5.5): 532.47
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 45.19
ACD/KOC (pH 7.4): 532.47
Polar Surface Area: 77 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 68.0±5.0 dyne/cm
Molar Volume: 117.5±5.0 cm3

Click to predict properties on the Chemicalize site


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