ChemSpider 2D Image | 4-Cyano-2-thiophenecarbothioamide | C6H4N2S2

4-Cyano-2-thiophenecarbothioamide

  • Molecular FormulaC6H4N2S2
  • Average mass168.239 Da
  • Monoisotopic mass167.981583 Da
  • ChemSpider ID65428064

More details:

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

2-Thiophenecarbothioamide, 4-cyano- [ACD/Index Name]
4-Cyan-2-thiophencarbothioamid [German] [ACD/IUPAC Name]
4-Cyano-2-thiophenecarbothioamide [ACD/IUPAC Name]
4-Cyano-2-thiophènecarbothioamide [French] [ACD/IUPAC Name]
2228407-55-2 [RN]
4-cyanothiophene-2-carbothioamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 338.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 158.6±30.7 °C
Index of Refraction: 1.705
Molar Refractivity: 44.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 4.57
ACD/KOC (pH 5.5): 103.31
ACD/LogD (pH 7.4): 1.17
ACD/BCF (pH 7.4): 4.57
ACD/KOC (pH 7.4): 103.31
Polar Surface Area: 110 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 87.4±5.0 dyne/cm
Molar Volume: 115.3±5.0 cm3

Click to predict properties on the Chemicalize site


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