Cas no 89837-32-1 (2-Naphthalenecarboxylic acid, 7-methoxy-5-methyl-, methyl ester)

2-Naphthalenecarboxylic acid, 7-methoxy-5-methyl-, methyl ester structure
89837-32-1 structure
Product Name:2-Naphthalenecarboxylic acid, 7-methoxy-5-methyl-, methyl ester
CAS No:89837-32-1
MF:C14H14O3
MW:230.259164333344
CID:587672
PubChem ID:71326448
Update Time:2025-04-19

2-Naphthalenecarboxylic acid, 7-methoxy-5-methyl-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-Naphthalenecarboxylic acid, 7-methoxy-5-methyl-, methyl ester
    • methyl 7-methoxy-5-methylnaphthalene-2-carboxylate
    • 89837-32-1
    • DTXSID80755647
    • Inchi: 1S/C14H14O3/c1-9-6-12(16-2)8-11-7-10(14(15)17-3)4-5-13(9)11/h4-8H,1-3H3
    • InChI Key: TVWCAUSGCMVRGY-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC(C)=C2C=CC(C(=O)OC)=CC2=C1

Computed Properties

  • Exact Mass: 230.094294304g/mol
  • Monoisotopic Mass: 230.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 277
  • 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: 3.4
  • Topological Polar Surface Area: 35.5?2
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