Cas no 121012-74-6 (Benzo[c]phenanthrene-5,8-diamine)

Benzo[c]phenanthrene-5,8-diamine structure
121012-74-6 structure
Product Name:Benzo[c]phenanthrene-5,8-diamine
CAS No:121012-74-6
MF:C18H14N2
MW:258.317163944244
CID:2889721
PubChem ID:14469190
Update Time:2025-04-21

Benzo[c]phenanthrene-5,8-diamine Chemical and Physical Properties

Names and Identifiers

    • DTXSID801302504
    • 121012-74-6
    • Benzo[c]phenanthrene-5,8-diamine
    • Inchi: 1S/C18H14N2/c19-16-9-11-10-17(20)13-6-2-4-8-15(13)18(11)14-7-3-1-5-12(14)16/h1-10H,19-20H2
    • InChI Key: BSPLFSTXNOUGPK-UHFFFAOYSA-N
    • SMILES: NC1C=C2C=C(C3C=CC=CC=3C2=C2C=CC=CC2=1)N

Computed Properties

  • Exact Mass: 258.115698455Da
  • Monoisotopic Mass: 258.115698455Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 0
  • Complexity: 323
  • 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: 4.3
  • Topological Polar Surface Area: 52?2
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