ChemSpider 2D Image | 7-Oxa-2,5-dithiabicyclo[2.2.1]heptane | C4H6OS2

7-Oxa-2,5-dithiabicyclo[2.2.1]heptane

  • Molecular FormulaC4H6OS2
  • Average mass134.220 Da
  • Monoisotopic mass133.986008 Da
  • ChemSpider ID57429791

More details:

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

7-Oxa-2,5-dithiabicyclo[2.2.1]heptan [German] [ACD/IUPAC Name]
7-Oxa-2,5-dithiabicyclo[2.2.1]heptane [ACD/Index Name] [ACD/IUPAC Name]
7-Oxa-2,5-dithiabicyclo[2.2.1]heptane [French] [ACD/Index Name] [ACD/IUPAC Name]
279-58-3 [RN]
7-OXA-2,5-DITHIABICYCLO[2.2.1]HEPTANE(7CI,8CI,9CI)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 261.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.9±3.0 kJ/mol
Flash Point: 111.7±25.9 °C
Index of Refraction: 1.643
Molar Refractivity: 34.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.48
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.92
ACD/KOC (pH 5.5): 92.51
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.92
ACD/KOC (pH 7.4): 92.51
Polar Surface Area: 60 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 59.6±3.0 dyne/cm
Molar Volume: 95.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement