Cas no 107430-57-9 (Benzoic acid,4-(6-methoxy-2-naphthalenyl)-)

Benzoic acid,4-(6-methoxy-2-naphthalenyl)- structure
107430-57-9 structure
Product Name:Benzoic acid,4-(6-methoxy-2-naphthalenyl)-
CAS No:107430-57-9
MF:C18H14O3
MW:278.301965236664
MDL:MFCD08457010
CID:127545
Update Time:2024-01-25

Benzoic acid,4-(6-methoxy-2-naphthalenyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,4-(6-methoxy-2-naphthalenyl)-
    • 4-(6-HYDROXYNAPHTHALEN-2-YL)BENZOIC ACID
    • 4-(6-methoxy-2-naphthalenyl)Benzoic acid
    • 2-(4'-Carboxyphenyl)-6-methoxynaphthalene
    • Benzoic acid,4-(6-methoxy-2-naphthalenyl)
    • Benzoic acid, 4-(6-methoxy-2-naphthalenyl)-
    • MDL: MFCD08457010
    • Inchi: 1S/C18H14O3/c1-21-17-9-8-15-10-14(6-7-16(15)11-17)12-2-4-13(5-3-12)18(19)20/h2-11H,1H3,(H,19,20)
    • InChI Key: CHAKHWYFOPIVQR-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C1=CC=C(C2=CC=C3C(=C2)C=CC(OC)=C3)C=C1

Computed Properties

  • Exact Mass: 264.07900
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 346
  • 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
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 4

Experimental Properties

  • Density: 1.234±0.06 g/cm3(Predicted)
  • Boiling Point: 483.3±33.0 °C(Predicted)
  • PSA: 57.53000
  • LogP: 3.91060
  • pka: 4.14±0.10(Predicted)

Benzoic acid,4-(6-methoxy-2-naphthalenyl)- Pricemore >>

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