ChemSpider 2D Image | 1-(Hydroxymethyl)-2-(methylsulfonyl)cyclopropanecarboxylic acid | C6H10O5S

1-(Hydroxymethyl)-2-(methylsulfonyl)cyclopropanecarboxylic acid

  • Molecular FormulaC6H10O5S
  • Average mass194.206 Da
  • Monoisotopic mass194.024887 Da
  • ChemSpider ID35505473

More details:

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

1-(Hydroxymethyl)-2-(methylsulfonyl)cyclopropancarbonsäure [German] [ACD/IUPAC Name]
1-(Hydroxymethyl)-2-(methylsulfonyl)cyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide 1-(hydroxyméthyl)-2-(méthylsulfonyl)cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 1-(hydroxymethyl)-2-(methylsulfonyl)- [ACD/Index Name]
1823640-08-9 [RN]
1-Hydroxymethyl-2-methanesulfonyl-cyclopropanecarboxylic acid
MFCD28146730

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 505.5±43.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 89.3±6.0 kJ/mol
    Flash Point: 259.5±28.2 °C
    Index of Refraction: 1.562
    Molar Refractivity: 39.8±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -2.44
    ACD/LogD (pH 5.5): -3.71
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 100 Å2
    Polarizability: 15.8±0.5 10-24cm3
    Surface Tension: 69.2±5.0 dyne/cm
    Molar Volume: 122.7±5.0 cm3

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