Cas no 854515-52-9 (6-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid)

6-Hydroxy-2-methyl-1-benzofuran-3-carboxylic acid is a benzofuran derivative with a hydroxyl and carboxylic acid functional group, making it a versatile intermediate in organic synthesis and pharmaceutical applications. Its structural features allow for further derivatization, enabling the development of bioactive compounds. The compound exhibits potential utility in medicinal chemistry due to its benzofuran core, which is present in various pharmacologically active molecules. Its carboxylic acid group facilitates conjugation or salt formation, enhancing solubility and reactivity. The hydroxyl group at the 6-position offers additional modification sites for tailored applications. This compound is suitable for research in drug discovery and material science, where precise functionalization is critical.
6-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid structure
854515-52-9 structure
Product Name:6-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid
CAS No:854515-52-9
MF:C10H8O4
MW:192.168123245239
MDL:MFCD12547297
CID:820214
PubChem ID:22143529
Update Time:2025-06-09

6-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 6-Hydroxy-2-methylbenzofuran-3-carboxylic acid
    • 6-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid
    • 6-Hydroxy-2-methyl-3-benzofurancarboxylic acid (ACI)
    • 6-Hydroxy-2-methyl-1-benzofuran-3-carboxylic acid, AldrichCPR
    • 854515-52-9
    • SCHEMBL2083566
    • TS-02708
    • JVELFLPOFDICQP-UHFFFAOYSA-N
    • MFCD12547297
    • DB-027118
    • F30042
    • 6-hydroxy-2-methylbenzofuran-3-carboxylicacid
    • CS-0456411
    • 6-hydroxy-2-methyl-benzofuran-3-carboxylic acid
    • DTXSID00622867
    • AKOS015909523
    • MDL： MFCD12547297
    • Inchi： 1S/C10H8O4/c1-5-9(10(12)13)7-3-2-6(11)4-8(7)14-5/h2-4,11H,1H3,(H,12,13)
    • InChI Key： JVELFLPOFDICQP-UHFFFAOYSA-N
    • SMILES： O=C(C1=C(C)OC2C1=CC=C(C=2)O)O

Computed Properties

  • Exact Mass: 192.04225873g/mol
  • Monoisotopic Mass: 192.04225873g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 240
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.9
  • Topological Polar Surface Area: 70.7?2

Experimental Properties

  • Boiling Point: 235.838 ℃ at 760 mmHg

6-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid Pricemore >>

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