ChemSpider 2D Image | 2-[4,5-Bis(ethylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarbonitrile | C12H10N2S6

2-[4,5-Bis(ethylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarbonitrile

  • Molecular FormulaC12H10N2S6
  • Average mass374.611 Da
  • Monoisotopic mass373.916809 Da
  • ChemSpider ID30656825

More details:

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

1,3-Dithiole-4,5-dicarbonitrile, 2-[4,5-bis(ethylthio)-1,3-dithiol-2-ylidene]- [ACD/Index Name]
2-[4,5-Bis(ethylsulfanyl)-1,3-dithiol-2-yliden]-1,3-dithiol-4,5-dicarbonitril [German] [ACD/IUPAC Name]
2-[4,5-Bis(ethylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarbonitrile [ACD/IUPAC Name]
2-[4,5-Bis(éthylsulfanyl)-1,3-dithiol-2-ylidène]-1,3-dithiole-4,5-dicarbonitrile [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 389.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.6±27.9 °C
Index of Refraction: 1.772
Molar Refractivity: 99.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 818.11
ACD/KOC (pH 5.5): 4232.45
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 818.11
ACD/KOC (pH 7.4): 4232.45
Polar Surface Area: 199 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 83.7±5.0 dyne/cm
Molar Volume: 239.8±5.0 cm3

Click to predict properties on the Chemicalize site


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