Cas no 84533-48-2 (1-Naphthalenecarboxylic acid, 4,6-dimethoxy-)

1-Naphthalenecarboxylic acid, 4,6-dimethoxy- structure
84533-48-2 structure
Product Name:1-Naphthalenecarboxylic acid, 4,6-dimethoxy-
CAS No:84533-48-2
MF:C13H12O4
MW:232.231984138489
CID:666998
PubChem ID:13123044
Update Time:2025-04-19

1-Naphthalenecarboxylic acid, 4,6-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenecarboxylic acid, 4,6-dimethoxy-
    • 4,6-dimethoxynaphthalene-1-carboxylic acid
    • FLGKCEHJBHUNQP-UHFFFAOYSA-N
    • SCHEMBL10390929
    • 4,6-dimethoxy-1naphthalenecarboxylic acid
    • 4,6-Dimethoxy-1-naphthalenecarboxylic acid
    • 4,6-dimethoxy-1-naphthlenecarboxylic acid
    • DTXSID70519679
    • 84533-48-2
    • Inchi: 1S/C13H12O4/c1-16-8-3-4-9-10(13(14)15)5-6-12(17-2)11(9)7-8/h3-7H,1-2H3,(H,14,15)
    • InChI Key: FLGKCEHJBHUNQP-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(C(=O)O)=C2C=CC(=CC2=1)OC

Computed Properties

  • Exact Mass: 232.07355886g/mol
  • Monoisotopic Mass: 232.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 279
  • 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: 2.6
  • Topological Polar Surface Area: 55.8?2
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