Cas no 1494-08-2 (8-fluorobenzo[e][2]benzofuran-1,3-dione)

8-fluorobenzo[e][2]benzofuran-1,3-dione structure
1494-08-2 structure
Product Name:8-fluorobenzo[e][2]benzofuran-1,3-dione
CAS No:1494-08-2
MF:C12H5FO3
MW:216.164706945419
CID:1321428
PubChem ID:247398
Update Time:2025-04-20

8-fluorobenzo[e][2]benzofuran-1,3-dione Chemical and Physical Properties

Names and Identifiers

    • 8-fluorobenzo[e][2]benzofuran-1,3-dione
    • AR-1H4576
    • NSC61880
    • AC1Q4NEE
    • CTK4C6200
    • 7-fluoro-naphthalene-1,2-dicarboxylic acid anhydride
    • 7-Fluor-1,2-naphthalsaeure-anhydrid
    • AG-J-33640
    • AC1L6K6K
    • 8-fluoronaphtho[1,2-c]furan-1,3-dione
    • AR-1H4576; NSC61880; AC1Q4NEE; CTK4C6200; 7-fluoro-naphthalene-1,2-dicarboxylic acid anhydride; 7-Fluor-1,2-naphthalsaeure-anhydrid; AG-J-33640; AC1L6K6K; 8-fluoronaphtho[1,2-c]furan-1,3-dione;
    • 1494-08-2
    • NSC-61880
    • DTXSID70289547
    • SCHEMBL4960256
    • Inchi: 1S/C12H5FO3/c13-7-3-1-6-2-4-8-10(9(6)5-7)12(15)16-11(8)14/h1-5H
    • InChI Key: RBPOSWUZKJSBLW-UHFFFAOYSA-N
    • SMILES: FC1C=CC2=CC=C3C(=O)OC(C3=C2C=1)=O

Computed Properties

  • Exact Mass: 216.02225
  • Monoisotopic Mass: 216.02227218g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 341
  • 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: 2.6
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37
  • LogP: 2.28950
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