Cas no 111220-35-0 (4-Isopropoxy-2-methylbenzoic acid)

4-Isopropoxy-2-methylbenzoic acid is a substituted benzoic acid derivative featuring an isopropoxy group at the 4-position and a methyl group at the 2-position. This compound is valued for its role as an intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. Its structural features, including the electron-donating isopropoxy group and the steric influence of the ortho-methyl substituent, make it useful for modulating reactivity in synthetic pathways. The compound exhibits good stability under standard conditions and can be further functionalized to yield more complex molecules. Its purity and consistent performance make it a reliable choice for research and industrial applications.
4-Isopropoxy-2-methylbenzoic acid structure
111220-35-0 structure
Product Name:4-Isopropoxy-2-methylbenzoic acid
CAS No:111220-35-0
MF:C11H14O3
MW:194.227063655853
MDL:MFCD19309246
CID:2144042
Update Time:2025-05-28

4-Isopropoxy-2-methylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-isopropoxy-2-methylbenzoic acid
    • 2-methyl-4-(propan-2-yloxy)benzoic acid
    • FTZOSZBGDBNSEM-UHFFFAOYSA-N
    • 4-Isopropoxy-2-methylbenzoic acid
    • MDL: MFCD19309246
    • Inchi: 1S/C11H14O3/c1-7(2)14-9-4-5-10(11(12)13)8(3)6-9/h4-7H,1-3H3,(H,12,13)
    • InChI Key: FTZOSZBGDBNSEM-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C(=O)O)=C(C)C=1)C(C)C

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 201
  • Topological Polar Surface Area: 46.5

4-Isopropoxy-2-methylbenzoic acid Pricemore >>

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