ChemSpider 2D Image | 4-(2-Methyl-2-propanyl)-3-sulfobenzoic acid | C11H14O5S

4-(2-Methyl-2-propanyl)-3-sulfobenzoic acid

  • Molecular FormulaC11H14O5S
  • Average mass258.291 Da
  • Monoisotopic mass258.056183 Da
  • ChemSpider ID29377129

More details:

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

4-(2-Methyl-2-propanyl)-3-sulfobenzoesäure [German] [ACD/IUPAC Name]
4-(2-Methyl-2-propanyl)-3-sulfobenzoic acid [ACD/IUPAC Name]
Acide 4-(2-méthyl-2-propanyl)-3-sulfobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(1,1-dimethylethyl)-3-sulfo- [ACD/Index Name]
1351386-75-8 [RN]
4-(tert-Butyl)-3-sulfobenzoic acid
4-tert-butyl-3-sulfobenzoic acid
4-tert-Butyl-3-sulfo-benzoic acid
AGN-PC-0ADVEG
AKOS005363175
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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:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.560
    Molar Refractivity: 61.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.23
    ACD/LogD (pH 5.5): -3.01
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 100 Å2
    Polarizability: 24.5±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 191.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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