ChemSpider 2D Image | 3-methoxy-1,1-dioxo-1lambda6-thiolane-3-carboxylic acid | C6H10O5S

3-methoxy-1,1-dioxo-1λ6-thiolane-3-carboxylic acid

  • Molecular FormulaC6H10O5S
  • Average mass194.206 Da
  • Monoisotopic mass194.024887 Da
  • ChemSpider ID43855111

More details:

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

1603109-80-3 [RN]
3-methoxy-1,1-dioxo-1λ6-thiolane-3-carboxylic acid
3-Methoxytetrahydro-3-thiophencarbonsäure-1,1-dioxid [German] [ACD/IUPAC Name]
3-Methoxytetrahydro-3-thiophenecarboxylic acid 1,1-dioxide [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, tetrahydro-3-methoxy-, 1,1-dioxide [ACD/Index Name]
Acide 1,1-dioxyde de 3-méthoxytétrahydro-3-thiophènecarboxylique [French] [ACD/IUPAC Name]
MFCD30197343

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

Density: 1.5±0.1 g/cm3
Boiling Point: 449.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±6.0 kJ/mol
Flash Point: 225.6±28.7 °C
Index of Refraction: 1.524
Molar Refractivity: 40.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.10
ACD/LogD (pH 5.5): -3.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 130.8±5.0 cm3

Click to predict properties on the Chemicalize site


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