ChemSpider 2D Image | (Cyclohexylsulfonyl)acetic acid | C8H14O4S

(Cyclohexylsulfonyl)acetic acid

  • Molecular FormulaC8H14O4S
  • Average mass206.259 Da
  • Monoisotopic mass206.061279 Da
  • ChemSpider ID14866514

More details:

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

(Cyclohexylsulfonyl)acetic acid [ACD/IUPAC Name]
(Cyclohexylsulfonyl)essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-(cyclohexylsulfonyl)- [ACD/Index Name]
Acide (cyclohexylsulfonyl)acétique [French] [ACD/IUPAC Name]
107347-86-4 [RN]
2-cyclohexylsulfonylacetic acid
AGN-PC-02OIVG
AKOS009222284
Cyclohexanesulfonyl-acetic acid
MFCD11167618
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 448.2±24.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.5±6.0 kJ/mol
    Flash Point: 224.8±22.9 °C
    Index of Refraction: 1.515
    Molar Refractivity: 47.5±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.83
    ACD/LogD (pH 5.5): -2.34
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 80 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 50.8±5.0 dyne/cm
    Molar Volume: 157.6±5.0 cm3

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