Cas no 10088-77-4 (7-hydroxy-4,6-dimethyl-3h-2-benzofuran-1-one)

7-hydroxy-4,6-dimethyl-3h-2-benzofuran-1-one structure
10088-77-4 structure
Product Name:7-hydroxy-4,6-dimethyl-3h-2-benzofuran-1-one
CAS No:10088-77-4
MF:C10H10O3
MW:178.184603214264
CID:1127318
PubChem ID:821361
Update Time:2025-04-20

7-hydroxy-4,6-dimethyl-3h-2-benzofuran-1-one Chemical and Physical Properties

Names and Identifiers

    • 7-hydroxy-4,6-dimethyl-3h-2-benzofuran-1-one
    • 7-Hydroxy-4.6-dimethyl-phthalid
    • SureCN3682437
    • 7-hydroxy-4,6-dimethyl-3H-isobenzofuran-1-one
    • 1(3H)-Isobenzofuranone, 7-hydroxy-4,6-dimethyl-
    • CTK0G8579
    • AC1LGHE7
    • 7-Hydroxy-4,6-dimethyl-phthalid
    • 7-hydroxy-4,6-dimethyl-phthalide
    • 7-Hydroxy-4.6-dimethyl-phthalid; SureCN3682437; 7-hydroxy-4,6-dimethyl-3H-isobenzofuran-1-one; 1(3H)-Isobenzofuranone, 7-hydroxy-4,6-dimethyl-; CTK0G8579; AC1LGHE7; 7-Hydroxy-4,6-dimethyl-phthalid; 7-hydroxy-4,6-dimethyl-phthalide;
    • 7-hydroxy-4,6-dimethylphthalide
    • SCHEMBL3682437
    • BS-1225
    • 10088-77-4
    • DTXSID30356305
    • 7-Hydroxy-4,6-dimethylisobenzofuran-1(3H)-one
    • Inchi: 1S/C10H10O3/c1-5-3-6(2)9(11)8-7(5)4-13-10(8)12/h3,11H,4H2,1-2H3
    • InChI Key: FCSPXCQJNMMNMO-UHFFFAOYSA-N
    • SMILES: O1C(C2C(=C(C)C=C(C)C=2C1)O)=O

Computed Properties

  • Exact Mass: 178.063
  • Monoisotopic Mass: 178.062994177g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 226
  • 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: 2.3
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53
  • LogP: 1.67940
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