ChemSpider 2D Image | 8-Chloro-5-isoquinolinesulfonic acid | C9H6ClNO3S

8-Chloro-5-isoquinolinesulfonic acid

  • Molecular FormulaC9H6ClNO3S
  • Average mass243.667 Da
  • Monoisotopic mass242.975693 Da
  • ChemSpider ID48059209

More details:

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

1246816-17-0 [RN]
5-Isoquinolinesulfonic acid, 8-chloro- [ACD/Index Name]
8-Chlor-5-isochinolinsulfonsäure [German] [ACD/IUPAC Name]
8-Chloro-5-isoquinolinesulfonic acid [ACD/IUPAC Name]
8-chloroisoquinoline-5-sulfonic acid
Acide 8-chloro-5-isoquinoléinesulfonique [French] [ACD/IUPAC Name]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.681
    Molar Refractivity: 57.3±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.07
    ACD/LogD (pH 5.5): -2.98
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.07
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 22.7±0.5 10-24cm3
    Surface Tension: 69.8±3.0 dyne/cm
    Molar Volume: 151.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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