ChemSpider 2D Image | 2-Hydroxy Probenecid | C13H19NO5S

2-Hydroxy Probenecid

  • Molecular FormulaC13H19NO5S
  • Average mass301.359 Da
  • Monoisotopic mass301.098389 Da
  • ChemSpider ID29790228

More details:

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

28242-02-6 [RN]
2-Hydroxy Probenecid
4-[(2-Hydroxypropyl)(propyl)sulfamoyl]benzoesäure [German] [ACD/IUPAC Name]
4-[(2-Hydroxypropyl)(propyl)sulfamoyl]benzoic acid [ACD/IUPAC Name]
Acide 4-[(2-hydroxypropyl)(propyl)sulfamoyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(2-hydroxypropyl)propylamino]sulfonyl]- [ACD/Index Name]
1330180-97-6 [RN]
2-Hydroxy probenacid
2-Hydroxy Probenecid-d6
4-[[(2-Hydroxypropyl)propylamino]sulfonyl]benzoic acid
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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: 490.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.7±3.0 kJ/mol
    Flash Point: 250.2±31.5 °C
    Index of Refraction: 1.562
    Molar Refractivity: 75.0±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.19
    ACD/LogD (pH 5.5): 0.31
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.21
    ACD/LogD (pH 7.4): -0.93
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 103 Å2
    Polarizability: 29.7±0.5 10-24cm3
    Surface Tension: 53.4±3.0 dyne/cm
    Molar Volume: 231.4±3.0 cm3

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