Cas no 919994-92-6 (2-Naphthalenecarboxylic acid, 3-chloro-5-hydroxy-, ethyl ester)

2-Naphthalenecarboxylic acid, 3-chloro-5-hydroxy-, ethyl ester structure
919994-92-6 structure
Product Name:2-Naphthalenecarboxylic acid, 3-chloro-5-hydroxy-, ethyl ester
CAS No:919994-92-6
MF:C13H11ClO3
MW:250.677643060684
CID:760298
PubChem ID:71424622
Update Time:2025-04-19

2-Naphthalenecarboxylic acid, 3-chloro-5-hydroxy-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-Naphthalenecarboxylic acid, 3-chloro-5-hydroxy-, ethyl ester
    • ethyl 3-chloro-5-hydroxynaphthalene-2-carboxylate
    • 919994-92-6
    • DTXSID60843415
    • Inchi: 1S/C13H11ClO3/c1-2-17-13(16)10-6-8-4-3-5-12(15)9(8)7-11(10)14/h3-7,15H,2H2,1H3
    • InChI Key: FZYUGQLGYPZCEQ-UHFFFAOYSA-N
    • SMILES: ClC1=CC2C(=CC=CC=2C=C1C(=O)OCC)O

Computed Properties

  • Exact Mass: 250.0396719g/mol
  • Monoisotopic Mass: 250.0396719g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 282
  • 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: 3.7
  • Topological Polar Surface Area: 46.5?2

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