Cas no 874498-26-7 (3,5-Quinolinediamine)

3,5-Quinolinediamine structure
3,5-Quinolinediamine structure
Product Name:3,5-Quinolinediamine
CAS No:874498-26-7
MF:C9H9N3
MW:159.187861204147
CID:709701
PubChem ID:53439778
Update Time:2025-04-19

3,5-Quinolinediamine Chemical and Physical Properties

Names and Identifiers

    • 3,5-Quinolinediamine
    • Quinoline, 3,5-diamino- (5CI)
    • quinoline-3,5-diamine
    • 874498-26-7
    • SB67411
    • DTXSID40702157
    • Inchi： 1S/C9H9N3/c10-6-4-7-8(11)2-1-3-9(7)12-5-6/h1-5H,10-11H2
    • InChI Key： XLBOKSBCSZFOSM-UHFFFAOYSA-N
    • SMILES： N1C=C(C=C2C(=CC=CC=12)N)N

Computed Properties

  • Exact Mass: 159.08
  • Monoisotopic Mass: 159.08
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 160
  • 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
  • Topological Polar Surface Area: 64.9A^2
  • Surface Charge: 0
  • Tautomer Count: 9
  • XLogP3: nothing

3,5-Quinolinediamine Related Literature

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