ChemSpider 2D Image | 3-Phenyl-5-[(1-phenylethyl)sulfanyl]-1,3,4-thiadiazole-2(3H)-thione | C16H14N2S3

3-Phenyl-5-[(1-phenylethyl)sulfanyl]-1,3,4-thiadiazole-2(3H)-thione

  • Molecular FormulaC16H14N2S3
  • Average mass330.491 Da
  • Monoisotopic mass330.031921 Da
  • ChemSpider ID22274634

More details:

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

1,3,4-Thiadiazole-2(3H)-thione, 3-phenyl-5-[(1-phenylethyl)thio]- [ACD/Index Name]
3-Phenyl-5-[(1-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-thion [German] [ACD/IUPAC Name]
3-Phenyl-5-[(1-phenylethyl)sulfanyl]-1,3,4-thiadiazole-2(3H)-thione [ACD/IUPAC Name]
3-Phényl-5-[(1-phényléthyl)sulfanyl]-1,3,4-thiadiazole-2(3H)-thione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 448.1±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.7±3.0 kJ/mol
Flash Point: 224.8±26.8 °C
Index of Refraction: 1.692
Molar Refractivity: 98.4±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 938.73
ACD/KOC (pH 5.5): 4670.32
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 938.73
ACD/KOC (pH 7.4): 4670.32
Polar Surface Area: 98 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 49.6±7.0 dyne/cm
Molar Volume: 257.0±7.0 cm3

Click to predict properties on the Chemicalize site


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