ChemSpider 2D Image | 5-[(Methylsulfonyl)methyl]-2-furoic acid | C7H8O5S

5-[(Methylsulfonyl)methyl]-2-furoic acid

  • Molecular FormulaC7H8O5S
  • Average mass204.200 Da
  • Monoisotopic mass204.009247 Da
  • ChemSpider ID21787456

More details:

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

2-Furancarboxylic acid, 5-[(methylsulfonyl)methyl]- [ACD/Index Name]
5-[(Methylsulfonyl)methyl]-2-furoesäure [German] [ACD/IUPAC Name]
5-[(Methylsulfonyl)methyl]-2-furoic acid [ACD/IUPAC Name]
Acide 5-[(méthylsulfonyl)méthyl]-2-furoïque [French] [ACD/IUPAC Name]
1092287-15-4 [RN]
5-((methylsulfonyl)methyl)furan-2-carboxylic acid
5-(methanesulfonylmethyl)furan-2-carboxylic acid
5-(methylsulfonylmethyl)furan-2-carboxylic acid
5-Methanesulfonylmethyl-furan-2-carboxylic acid
AC1Q4GM5
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 491.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.8±3.0 kJ/mol
    Flash Point: 250.9±27.3 °C
    Index of Refraction: 1.541
    Molar Refractivity: 43.6±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.89
    ACD/LogD (pH 5.5): -2.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.24
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 93 Å2
    Polarizability: 17.3±0.5 10-24cm3
    Surface Tension: 58.4±3.0 dyne/cm
    Molar Volume: 138.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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