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      1,1,2-Trimethyl-3-(4-sulfobutyl)benz[e]benzindolium, inner salt

      SKU
      T0061

      Category: Building Blocks, Intermediates, Reagents

      63149-24-6
      CAS-Number
      C19H23NO3S
      Molecular Formula
      345.46
      Molecular Weight

      For Research Use Only. Not Intended for Diagnostic or Therapeutic Use.

      • Product Data
      • Handling
      • Safety Information
      • Details

      Specifications

      Purity
      ~90% (Dye Content) (UV/Vis)
      Appearance
      Solid
      Identity
      1H-NMR

      Properties

      Solvents
      DMSO
      Melting Point
      274-278 °C
      Fluorescence
      λex 319 nm, λem 457 nm in DMSO
      Shipping
      AMBIENT
      Short Term Storage
      +4°C
      Long Term Storage
      -20°C
      Handling Advice
      Protect from light and moisture.
      Use / Stability
      Stable for at least 2 years after receipt when stored at -20°C.
      Transportation
      Not dangerous goods
      Description
      Building block for synthesis. Reagent used for electrophilic phenylation, e.g. of malonates and dithiocarboxylates.
      Smiles
      CC1=[N+](CCCCS([O-])(=O)=O)C2=C(C3=C(C=CC=C3)C=C2)C1(C)C
      InChi Key
      GJCURKVOCXJAIV-UHFFFAOYSA-N
      InChi
      InChI=1S/C19H23NO3S/c1-14-19(2,3)18-16-9-5-4-8-15(16)10-11-17(18)20(14)12-6-7-13-24(21,22)23/h4-5,8-11H,6-7,12-13H2,1-3H3

      Building block for synthesis. Reagent used for electrophilic phenylation, e.g. of malonates and dithiocarboxylates.

      SKU: T0061 Category: Building Blocks, Intermediates, Reagents
      • Additional information

      Additional information

      Purity

      ~90% (Dye Content) (UV/Vis)

      Appearance

      Solid

      CAS-Number

      63149-24-6

      Molecular Formula

      C19H23NO3S

      Molecular Weight

      345.46

      Identity

      1H-NMR

      Solvents

      DMSO

      Melting Point

      274-278 °C

      Fluorescence

      λex 319 nm, λem 457 nm in DMSO

      Smiles

      CC1=[N+](CCCCS([O-])(=O)=O)C2=C(C3=C(C=CC=C3)C=C2)C1(C)C

      InChi Key

      GJCURKVOCXJAIV-UHFFFAOYSA-N

      Shipping

      AMBIENT

      Short Term Storage

      +4°C

      Long Term Storage

      -20°C

      Handling Advice

      Protect from light and moisture.

      Use / Stability

      Stable for at least 2 years after receipt when stored at -20°C.

      Transportation

      Not dangerous goods

      InChi

      InChI=1S/C19H23NO3S/c1-14-19(2,3)18-16-9-5-4-8-15(16)10-11-17(18)20(14)12-6-7-13-24(21,22)23/h4-5,8-11H,6-7,12-13H2,1-3H3

      Quantity

      500 mg, 2.5 g, Bulk

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