Cas no 62635-64-7 (Sodium;2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-8-sulfonate)

Sodium;2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-8-sulfonate structure
62635-64-7 structure
Product Name:Sodium;2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-8-sulfonate
CAS No:62635-64-7
MF:C12H5NaO6S
MW:300.219273328781
CID:2675124
Update Time:2023-08-06

Sodium;2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-8-sulfonate Chemical and Physical Properties

Names and Identifiers

    • 1,3-Dioxo-1H,3H-naphtho[1,8-cd]pyran-6-sulfonic acid sodium salt
    • Sodium;2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-8-sulfonate
    • Inchi: 1S/C12H6O6S.Na/c13-11-7-3-1-2-6-9(19(15,16)17)5-4-8(10(6)7)12(14)18-11;/h1-5H,(H,15,16,17);/q;+1/p-1
    • InChI Key: PPIIEQFKMOVLIO-UHFFFAOYSA-M
    • SMILES: S(C1=CC=C2C(=O)OC(C3C=CC=C1C2=3)=O)(=O)(=O)[O-].[Na+]

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 1
  • Complexity: 525
  • Topological Polar Surface Area: 109

Sodium;2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-8-sulfonate Related Literature

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