2-{[1-(3-methylphenyl)-1H-tetrazol-5-yl]thio}propanoic acid
Weight264.31 g/mol
FormulaC11H12N4O2S
Hydrogen Acceptors6
Hydrogen Donors1
Aromatic Rings2
Rotatable Bonds4

2-{[1-(3-methylphenyl)-1H-tetrazol-5-yl]thio}propanoic acid (917217-91-5)

917217-91-5

Suppliers

Alternate Names

  • 917217-91-5
  • SMILES
    CC1=CC(=CC=C1)N2C(=NN=N2)SC(C)C(=O)O
  • InChIKey
    KRXDTLGLJWDPFI-UHFFFAOYSA-N

Estimated Properties

Boiling Point 342.99 C EPA T.E.S.T.
Boiling Point 428.21 C EPI Suite
Density 1.4 g/cm3 EPA T.E.S.T.
Flash Point 217.04 C EPA T.E.S.T.
Melting Point 179.06 C EPI Suite
Water Solubility 302.83 mg/L EPA T.E.S.T.
Water Solubility 25106 mg/L EPI Suite

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