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3-(1H-1,2,4-triazol-1-ylmethyl)aniline
Weight174.207 g/mol
FormulaC9H10N4
Hydrogen Acceptors4
Hydrogen Donors1
Aromatic Rings2
Rotatable Bonds2

3-(1H-1,2,4-triazol-1-ylmethyl)aniline (127988-22-1)

127988-22-1

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Alternate Names

  • 127988-22-1
  • SMILES
    C1=CC(=CC(=C1)N)CN2C=NC=N2
  • InChIKey
    LFINNEVQJQXPHN-UHFFFAOYSA-N

Estimated Properties

Boiling Point 303.49 C EPA T.E.S.T.
Boiling Point 325.19 C EPI Suite
Density 1.25 g/cm3 EPA T.E.S.T.
Flash Point 170.64 C EPA T.E.S.T.
Melting Point 112.08 C EPI Suite
Water Solubility 3587.29 mg/L EPA T.E.S.T.
Water Solubility 51588 mg/L EPI Suite

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