ChemSpider 2D Image | 8-Thiabicyclo[5.2.0]nona-1(9),2,4,6-tetraene | C8H6S

8-Thiabicyclo[5.2.0]nona-1(9),2,4,6-tetraene

  • Molecular FormulaC8H6S
  • Average mass134.198 Da
  • Monoisotopic mass134.019012 Da
  • ChemSpider ID62899695

More details:

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

8-Thiabicyclo[5.2.0]nona-1(9),2,4,6-tetraen [German] [ACD/IUPAC Name]
8-Thiabicyclo[5.2.0]nona-1(9),2,4,6-tetraene [ACD/IUPAC Name]
8-Thiabicyclo[5.2.0]nona-1(9),2,4,6-tétraène [French] [ACD/IUPAC Name]
8-Thiabicyclo[5.2.0]nona-2,4,6,9-tetraene [ACD/Index Name]
3987-04-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 361.0±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.3±3.0 kJ/mol
Flash Point: 180.5±15.4 °C
Index of Refraction: 1.690
Molar Refractivity: 42.2±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 22.75
ACD/KOC (pH 5.5): 325.76
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 22.75
ACD/KOC (pH 7.4): 325.76
Polar Surface Area: 25 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 110.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement