Cas no 64483-12-1 (2-Methylnaphtho[2,1-B]furan-1-carboxylic acid)

2-Methylnaphtho[2,1-B]furan-1-carboxylic acid structure
64483-12-1 structure
Product Name:2-Methylnaphtho[2,1-B]furan-1-carboxylic acid
CAS No:64483-12-1
MF:C14H10O3
MW:226.227404117584
CID:2792143
PubChem ID:12376135
Update Time:2025-04-21

2-Methylnaphtho[2,1-B]furan-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 64483-12-1
    • 2-METHYLNAPHTHO[2,1-B]FURAN-1-CARBOXYLIC ACID
    • DTXSID10495100
    • 2-Methylnaphtho[2,1-B]furan-1-carboxylic acid
    • Inchi: 1S/C14H10O3/c1-8-12(14(15)16)13-10-5-3-2-4-9(10)6-7-11(13)17-8/h2-7H,1H3,(H,15,16)
    • InChI Key: WCYQLWMVFCJRKU-UHFFFAOYSA-N
    • SMILES: O1C(C)=C(C(=O)O)C2=C1C=CC1C=CC=CC2=1

Computed Properties

  • Exact Mass: 226.062994177Da
  • Monoisotopic Mass: 226.062994177Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 315
  • 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: 3.5
  • Topological Polar Surface Area: 50.4?2
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