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Weight226.029 g/mol
FormulaC8H4BrNO2
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings1
Rotatable Bonds0

4-bromoisatin (20780-72-7)

4-bromo-1H-indole-2,3-dione  ·  20780-72-7

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Alternate Names

  • 4-bromo-1H-indole-2,3-dione
  • 20780-72-7
  • SMILES
    C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2
  • InChIKey
    ITRAKBJPMLKWIW-UHFFFAOYSA-N

Estimated Properties

Boiling Point 324.45 C EPA T.E.S.T.
Boiling Point 382.66 C EPI Suite
Density 1.59 g/cm3 EPA T.E.S.T.
Flash Point 169.92 C EPA T.E.S.T.
Melting Point 156.66 C EPI Suite
Water Solubility 386.19 mg/L EPA T.E.S.T.
Water Solubility 3305.7 mg/L EPI Suite

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Synthesis

Reactant  +  2-Amino-6-bromobenzaldehyde (Schotten-Baumann amide from acid)
Synthesis of 4-bromoisatin ›

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