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3-Chlorobenzo[b]thiophene-2-carboxylic acid
Weight212.657 g/mol
FormulaC9H5ClO2S
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings2
Rotatable Bonds1

3-Chlorobenzo[b]thiophene-2-carboxylic acid (21211-22-3)

3-chloro-1-benzothiophene-2-carboxylic acid  ·  21211-22-3

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Alternate Names

  • 3-chloro-1-benzothiophene-2-carboxylic acid
  • 21211-22-3
  • SMILES
    C1=CC=C2C(=C1)C(=C(S2)C(=O)O)Cl
  • InChIKey
    HJTMIYKPPPYDRJ-UHFFFAOYSA-N

Estimated Properties

Boiling Point 324.18 C EPA T.E.S.T.
Boiling Point 364.25 C EPI Suite
Density 1.5 g/cm3 EPA T.E.S.T.
Flash Point 163.66 C EPA T.E.S.T.
Melting Point 133.8 C EPI Suite
Water Solubility 360.02 mg/L EPA T.E.S.T.
Water Solubility 23.352 mg/L EPI Suite

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