ChemSpider 2D Image | 10,10,11,11-Tetramethyl-12-phenyl-9-thia-12-azatricyclo[6.3.1.0~2,7~]dodeca-2,4,6-triene | C20H23NS

10,10,11,11-Tetramethyl-12-phenyl-9-thia-12-azatricyclo[6.3.1.02,7]dodeca-2,4,6-triene

  • Molecular FormulaC20H23NS
  • Average mass309.468 Da
  • Monoisotopic mass309.155121 Da
  • ChemSpider ID31020065

More details:

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

10,10,11,11-Tetramethyl-12-phenyl-9-thia-12-azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien [German] [ACD/IUPAC Name]
10,10,11,11-Tetramethyl-12-phenyl-9-thia-12-azatricyclo[6.3.1.02,7]dodeca-2,4,6-triene [ACD/IUPAC Name]
10,10,11,11-Tétraméthyl-12-phényl-9-thia-12-azatricyclo[6.3.1.02,7]dodéca-2,4,6-triène [French] [ACD/IUPAC Name]
2-Benzothiepin-1,5-imine, 1,3,4,5-tetrahydro-3,3,4,4-tetramethyl-10-phenyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 436.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 217.7±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 95.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8018.89
ACD/KOC (pH 5.5): 21679.66
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8025.50
ACD/KOC (pH 7.4): 21697.52
Polar Surface Area: 29 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 284.3±3.0 cm3

Click to predict properties on the Chemicalize site


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