Cas no 130818-32-5 (8-Phenylnaphthalene-1-carboxylic acid)

8-Phenylnaphthalene-1-carboxylic acid structure
130818-32-5 structure
Product Name:8-Phenylnaphthalene-1-carboxylic acid
CAS No:130818-32-5
MF:C17H12O2
MW:248.275984764099
CID:2770027
PubChem ID:53485688
Update Time:2025-04-21

8-Phenylnaphthalene-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 8-Phenylnaphthalene-1-carboxylic acid
    • 130818-32-5
    • DB-083965
    • DTXSID00704773
    • DTXCID70655521
    • Inchi: 1S/C17H12O2/c18-17(19)15-11-5-9-13-8-4-10-14(16(13)15)12-6-2-1-3-7-12/h1-11H,(H,18,19)
    • InChI Key: MLIDMVMMZZFWFZ-UHFFFAOYSA-N
    • SMILES: OC(C1C=CC=C2C=CC=C(C3C=CC=CC=3)C2=1)=O

Computed Properties

  • Exact Mass: 248.083729621Da
  • Monoisotopic Mass: 248.083729621Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 319
  • 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: 4.3
  • Topological Polar Surface Area: 37.3?2
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