Found 2 results

Search term: PVKWIOBXPPFARA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 6-Hydroxy-3-[(~2~H_7_)-2-propanyl]-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide | C10H5D7N2O4S

6-Hydroxy-3-[(2H7)-2-propanyl]-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide

  • Molecular FormulaC10H5D7N2O4S
  • Average mass263.321 Da
  • Monoisotopic mass263.095703 Da
  • ChemSpider ID48060996

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-2,1,3-Benzothiadiazin-4(3H)-one, 6-hydroxy-3-[1-(methyl-d3)ethyl-1,2,2,2-d4]-, 2,2-dioxide [ACD/Index Name]
2,2-Dioxyde de 6-hydroxy-3-[(2H7)-2-propanyl]-1H-2,1,3-benzothiadiazin-4(3H)-one [French] [ACD/IUPAC Name]
6-Hydroxy-3-[(2H7)-2-propanyl]-1H-2,1,3-benzothiadiazin-4(3H)-on-2,2-dioxid [German] [ACD/IUPAC Name]
6-Hydroxy-3-[(2H7)-2-propanyl]-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide [ACD/IUPAC Name]
1330180-76-1 [RN]
3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-hydroxy-2,2-dioxo-1H-2λ6,1,3-benzothiadiazin-4-one

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 477.6±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 77.0±3.0 kJ/mol
    Flash Point: 242.7±29.3 °C
    Index of Refraction: 1.608
    Molar Refractivity: 61.2±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.06
    ACD/LogD (pH 5.5): -0.12
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.51
    ACD/LogD (pH 7.4): -0.43
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.71
    Polar Surface Area: 95 Å2
    Polarizability: 24.3±0.5 10-24cm3
    Surface Tension: 56.5±3.0 dyne/cm
    Molar Volume: 177.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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