3-{[(chloroacetyl)amino]methyl}-4-methylbenzoic acid
Weight241.674 g/mol
FormulaC11H12ClNO3
Hydrogen Acceptors2
Hydrogen Donors2
Aromatic Rings1
Rotatable Bonds4

3-{[(chloroacetyl)amino]methyl}-4-methylbenzoic acid (727673-69-0)

727673-69-0

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Alternate Names

  • 727673-69-0
  • SMILES
    CC1=C(C=C(C=C1)C(=O)O)CNC(=O)CCl
  • InChIKey
    VYZGEFRTMAUBAV-UHFFFAOYSA-N

Estimated Properties

Boiling Point 351.95 C EPA T.E.S.T.
Boiling Point 442.66 C EPI Suite
Density 1.35 g/cm3 EPA T.E.S.T.
Flash Point 230.23 C EPA T.E.S.T.
Melting Point 185.81 C EPI Suite
Water Solubility 737.08 mg/L EPA T.E.S.T.
Water Solubility 599.07 mg/L EPI Suite

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