ChemSpider 2D Image | 5-Methyl-4-sulfino-2-furoic acid | C6H6O5S

5-Methyl-4-sulfino-2-furoic acid

  • Molecular FormulaC6H6O5S
  • Average mass190.174 Da
  • Monoisotopic mass189.993591 Da
  • ChemSpider ID75718940

More details:

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

2-Furancarboxylic acid, 5-methyl-4-sulfino- [ACD/Index Name]
5-Methyl-4-sulfino-2-furoesäure [German] [ACD/IUPAC Name]
5-Methyl-4-sulfino-2-furoic acid [ACD/IUPAC Name]
Acide 5-méthyl-4-sulfino-2-furoïque [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 506.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.7±3.0 kJ/mol
Flash Point: 259.8±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 40.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -4.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 110.8±5.0 dyne/cm
Molar Volume: 107.1±5.0 cm3

Click to predict properties on the Chemicalize site


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