Cas no 80038-46-6 (Quinolinium,1,1'-(1,3-propanediyl)bis-)

Quinolinium,1,1'-(1,3-propanediyl)bis- structure
80038-46-6 structure
Product Name:Quinolinium,1,1'-(1,3-propanediyl)bis-
CAS No:80038-46-6
MF:C21H20N2
MW:300.396904945374
CID:726276
PubChem ID:133340
Update Time:2025-04-19

Quinolinium,1,1'-(1,3-propanediyl)bis- Chemical and Physical Properties

Names and Identifiers

    • Quinolinium,1,1'-(1,3-propanediyl)bis-
    • 1-(3-quinolin-1-ium-1-ylpropyl)quinolin-1-ium
    • propylinium
    • Quinolinium, 1,1'-(1,3-propanediyl)bis-
    • 1,1''-prop-1,3-diyl-bis(quinolinium)dibromide
    • 80038-46-6
    • CHEMBL1761991
    • DTXSID50230037
    • CHEMBL1789170
    • SCHEMBL20151718
    • BDBM50339944
    • 1,1'-Trimethylene-bis(quinolinium)
    • Inchi: 1S/C21H20N2/c1-3-12-20-18(8-1)10-5-14-22(20)16-7-17-23-15-6-11-19-9-2-4-13-21(19)23/h1-6,8-15H,7,16-17H2/q+2
    • InChI Key: XKOPPJJSUOIQCM-UHFFFAOYSA-N
    • SMILES: [N+]1(=CC=CC2C=CC=CC1=2)CCC[N+]1=CC=CC2C=CC=CC1=2

Computed Properties

  • Exact Mass: 300.163
  • Monoisotopic Mass: 300.163
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 4
  • Complexity: 335
  • 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
  • Surface Charge: 2
  • Tautomer Count: nothing
  • XLogP3: 4.6
  • Topological Polar Surface Area: 7.8?2
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