ChemSpider 2D Image | 4,5-Dihydrothieno[2,3-b]thiophene-2-carbonitrile | C7H5NS2

4,5-Dihydrothieno[2,3-b]thiophene-2-carbonitrile

  • Molecular FormulaC7H5NS2
  • Average mass167.251 Da
  • Monoisotopic mass166.986343 Da
  • ChemSpider ID73174166

More details:






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

4,5-Dihydrothieno[2,3-b]thiophen-2-carbonitril [German] [ACD/IUPAC Name]
4,5-Dihydrothieno[2,3-b]thiophene-2-carbonitrile [ACD/IUPAC Name]
4,5-Dihydrothiéno[2,3-b]thiophène-2-carbonitrile [French] [ACD/IUPAC Name]
Thieno[2,3-b]thiophene-2-carbonitrile, 4,5-dihydro- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 285.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 126.2±27.3 °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: 1.95
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 45.45
ACD/KOC (pH 5.5): 534.65
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 45.45
ACD/KOC (pH 7.4): 534.65
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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