ChemSpider 2D Image | 1,4-Dithiaspiro[4.5]decan-7-one | C8H12OS2

1,4-Dithiaspiro[4.5]decan-7-one

  • Molecular FormulaC8H12OS2
  • Average mass188.310 Da
  • Monoisotopic mass188.032959 Da
  • ChemSpider ID30798658

More details:

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

1,4-Dithiaspiro[4.5]decan-7-on [German] [ACD/IUPAC Name]
1,4-Dithiaspiro[4.5]decan-7-one [ACD/Index Name] [ACD/IUPAC Name]
1,4-Dithiaspiro[4.5]décan-7-one [French] [ACD/IUPAC Name]
80563-98-0 [RN]
MFCD15143367

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

Density: 1.3±0.1 g/cm3
Boiling Point: 339.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.3±3.0 kJ/mol
Flash Point: 154.8±16.6 °C
Index of Refraction: 1.602
Molar Refractivity: 51.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.77
ACD/KOC (pH 5.5): 250.67
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.77
ACD/KOC (pH 7.4): 250.67
Polar Surface Area: 68 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 50.4±5.0 dyne/cm
Molar Volume: 149.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement