Cas no 23950-43-8 (Acridine, sulfate (2:1))

Acridine, sulfate (2:1) structure
Acridine, sulfate (2:1) structure
Product Name:Acridine, sulfate (2:1)
CAS No:23950-43-8
MF:C26H20N2O4S
MW:456.513005256653
CID:1419498
PubChem ID:71357986
Update Time:2025-04-20

Acridine, sulfate (2:1) Chemical and Physical Properties

Names and Identifiers

    • Acridine, sulfate (2:1)
    • acridine,sulfuric acid
    • DTXSID70782023
    • Sulfuric acid--acridine (1/2)
    • Acridine hemisulfate
    • 23950-43-8
    • Inchi: 1S/2C13H9N.H2O4S/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;1-5(2,3)4/h2*1-9H;(H2,1,2,3,4)
    • InChI Key: LNRLTXDHZCTQQS-UHFFFAOYSA-N
    • SMILES: S(=O)(=O)(O)O.N1C2C=CC=CC=2C=C2C=CC=CC=12.N1C2C=CC=CC=2C=C2C=CC=CC=12

Computed Properties

  • Exact Mass: 456.1145
  • Monoisotopic Mass: 456.11437830g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 0
  • Complexity: 263
  • Covalently-Bonded Unit Count: 3
  • 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

Experimental Properties

  • PSA: 100.38
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