4-[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid
Weight295.682 g/mol
FormulaC12H10ClN3O4
Hydrogen Acceptors5
Hydrogen Donors1
Aromatic Rings2
Rotatable Bonds4

4-[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid (491831-83-5)

491831-83-5

Suppliers

Alternate Names

  • 491831-83-5
  • SMILES
    CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)O)[N+](=O)[O-])Cl
  • InChIKey
    RPDSHNBIFOPINO-UHFFFAOYSA-N

Estimated Properties

Boiling Point 372.37 C EPA T.E.S.T.
Boiling Point 446.8 C EPI Suite
Density 1.49 g/cm3 EPA T.E.S.T.
Flash Point 239.15 C EPA T.E.S.T.
Melting Point 187.75 C EPI Suite
Water Solubility 36.92 mg/L EPA T.E.S.T.
Water Solubility 17.742 mg/L EPI Suite

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