Cas no 4199-91-1 (1,10-Phenanthroline;sulfuric acid)

1,10-Phenanthroline;sulfuric acid structure
4199-91-1 structure
Product Name:1,10-Phenanthroline;sulfuric acid
CAS No:4199-91-1
MF:C12H10N2O4S
MW:278.283801555634
CID:2827050
PubChem ID:67202878
Update Time:2025-04-21

1,10-Phenanthroline;sulfuric acid Chemical and Physical Properties

Names and Identifiers

    • DTXSID50736605
    • SCHEMBL1893812
    • 4199-91-1
    • Sulfuric acid--1,10-phenanthroline (1/1)
    • 1,10-Phenanthroline;sulfuric acid
    • Inchi: 1S/C12H8N2.H2O4S/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;1-5(2,3)4/h1-8H;(H2,1,2,3,4)
    • InChI Key: ZZLYVQNKPGBXIJ-UHFFFAOYSA-N
    • SMILES: S(=O)(=O)(O)O.N1C=CC=C2C=CC3=CC=CN=C3C=12

Computed Properties

  • Exact Mass: 278.03612798Da
  • Monoisotopic Mass: 278.03612798Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 0
  • Complexity: 264
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 109?2
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