[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetic acid
Weight288.332 g/mol
FormulaC13H12N4O2S
Hydrogen Acceptors6
Hydrogen Donors1
Aromatic Rings3
Rotatable Bonds4

[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetic acid (337489-46-0)

337489-46-0

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Alternate Names

  • 337489-46-0
  • SMILES
    CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)O
  • InChIKey
    DPEKWNQGZBHWKV-UHFFFAOYSA-N

Estimated Properties

Boiling Point 453.08 C EPA T.E.S.T.
Boiling Point 494.67 C EPI Suite
Density 1.47 g/cm3 EPA T.E.S.T.
Flash Point 285.57 C EPA T.E.S.T.
Melting Point 210.11 C EPI Suite
Water Solubility 34.77 mg/L EPA T.E.S.T.
Water Solubility 4485.1 mg/L EPI Suite

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