ChemSpider 2D Image | 4-[(5-Amino-1,3,4-thiadiazol-2-yl)methoxy]benzenesulfonic acid | C9H9N3O4S2

4-[(5-Amino-1,3,4-thiadiazol-2-yl)methoxy]benzenesulfonic acid

  • Molecular FormulaC9H9N3O4S2
  • Average mass287.315 Da
  • Monoisotopic mass287.003448 Da
  • ChemSpider ID21468181

More details:

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

4-[(5-amino-1,3,4-thiadiazol-2-yl)methoxy]benzene-1-sulfonic acid
4-[(5-Amino-1,3,4-thiadiazol-2-yl)methoxy]benzenesulfonic acid [ACD/IUPAC Name]
4-[(5-Amino-1,3,4-thiadiazol-2-yl)methoxy]benzolsulfonsäure [German] [ACD/IUPAC Name]
952959-27-2 [RN]
Acide 4-[(5-amino-1,3,4-thiadiazol-2-yl)méthoxy]benzènesulfonique [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-[(5-amino-1,3,4-thiadiazol-2-yl)methoxy]- [ACD/Index Name]
[952959-27-2] [RN]
4-((5-Amino-1,3,4-thiadiazol-2-yl)methoxy)benzenesulfonic acid
4-((5-imino-4,5-dihydro-1,3,4-thiadiazol-2-yl)methoxy)benzenesulfonic acid
4-(5-Amino-[1,3,4]thiadiazol-2-ylmethoxy)-benzenesulfonic acid
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    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: 1.672
    Molar Refractivity: 65.5±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.31
    ACD/LogD (pH 5.5): -3.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.86
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 152 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 88.2±3.0 dyne/cm
    Molar Volume: 175.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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