ChemSpider 2D Image | 1,6-Dimethyl-2-oxo-4-oxatricyclo[4.3.0.0~3,7~]nonane-3-sulfonic acid | C10H14O5S

1,6-Dimethyl-2-oxo-4-oxatricyclo[4.3.0.03,7]nonane-3-sulfonic acid

  • Molecular FormulaC10H14O5S
  • Average mass246.280 Da
  • Monoisotopic mass246.056198 Da
  • ChemSpider ID21783060

More details:

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

1,4-Methano-1H-cyclopenta[c]furan-1-sulfonic acid, hexahydro-3a,4-dimethyl-7-oxo- [ACD/Index Name]
1,6-Dimethyl-2-oxo-4-oxatricyclo[4.3.0.03,7]nonan-3-sulfonsäure [German] [ACD/IUPAC Name]
1,6-Dimethyl-2-oxo-4-oxatricyclo[4.3.0.03,7]nonane-3-sulfonic acid [ACD/IUPAC Name]
Acide 1,6-diméthyl-2-oxo-4-oxatricyclo[4.3.0.03,7]nonane-3-sulfonique [French] [ACD/IUPAC Name]
3a,4-dimethyl-7-oxohexahydro-1H-1,4-methanocyclopenta[c]furan-1-sulfonic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.595
Molar Refractivity: 54.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.40
ACD/LogD (pH 5.5): -4.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 62.8±5.0 dyne/cm
Molar Volume: 160.2±5.0 cm3

Click to predict properties on the Chemicalize site


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