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ISOTHIAZOLE-5-CARBALDEHYDE
Weight113.141 g/mol
FormulaC4H3NOS
Hydrogen Acceptors3
Hydrogen Donors0
Aromatic Rings1
Rotatable Bonds1

ISOTHIAZOLE-5-CARBALDEHYDE (5242-57-9)

5-isothiazolecarbaldehyde  ·  5242-57-9

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Alternate Names

  • 5-isothiazolecarbaldehyde
  • 5242-57-9
  • SMILES
    C1=C(SN=C1)C=O
  • InChIKey
    TVFJIXAFZXREJQ-UHFFFAOYSA-N

Estimated Properties

Boiling Point 180.33 C EPA T.E.S.T.
Boiling Point 200.75 C EPI Suite
Density 1.3 g/cm3 EPA T.E.S.T.
Flash Point 56.86 C EPA T.E.S.T.
Melting Point 29.65 C EPI Suite
Water Solubility 12737.6 mg/L EPA T.E.S.T.
Water Solubility 99442 mg/L EPI Suite

External Links

Synthesis

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