Cas no 135653-94-0 (Methanesulfonic acid, trifluoro-, 7-methoxy-2-naphthalenyl ester)

Methanesulfonic acid, trifluoro-, 7-methoxy-2-naphthalenyl ester structure
135653-94-0 structure
Product Name:Methanesulfonic acid, trifluoro-, 7-methoxy-2-naphthalenyl ester
CAS No:135653-94-0
MF:C12H9F3O4S
MW:306.257673025131
CID:1238607
PubChem ID:10892112
Update Time:2025-04-20

Methanesulfonic acid, trifluoro-, 7-methoxy-2-naphthalenyl ester Chemical and Physical Properties

Names and Identifiers

    • Methanesulfonic acid, trifluoro-, 7-methoxy-2-naphthalenyl ester
    • (7-methoxynaphthalen-2-yl) trifluoromethanesulfonate
    • 7-Methoxy-2-trifluoromethanesulfonyloxynaphthalene
    • trifluoro-methanesulfonic acid 7-methoxy-naphthalen-2-yl ester
    • SCHEMBL1179389
    • 7-methoxy-2-trifluoromethanesulfonyloxy naphthalene
    • trifluoromethanesulfonic acid 7-methoxy-naphthalen-2-yl ester
    • 7-Methoxy-2-naphthyl trifluoromethanesulfonate
    • 7-methoxy-2-naphthalenyl 1,1,1-trifluoromethanesulfonate
    • DTXSID20447433
    • 7-(methyloxy)-2-naphthalenyl trifluoromethanesulfonate
    • 135653-94-0
    • 7-methoxynaphthalen-2-yl trifluoromethane sulfonate
    • Inchi: 1S/C12H9F3O4S/c1-18-10-4-2-8-3-5-11(7-9(8)6-10)19-20(16,17)12(13,14)15/h2-7H,1H3
    • InChI Key: JCYLGNNXACDGDA-UHFFFAOYSA-N
    • SMILES: S(C(F)(F)F)(=O)(=O)OC1=CC=C2C=CC(=CC2=C1)OC

Computed Properties

  • Exact Mass: 306.01737
  • Monoisotopic Mass: 306.01736442g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 429
  • 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: 3.9
  • Topological Polar Surface Area: 61?2

Experimental Properties

  • PSA: 52.6
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