Cas no 89972-80-5 (2,2':6',2''-Terpyridine, 4'-(4-methoxyphenyl)-, hydrobromide)

2,2':6',2''-Terpyridine, 4'-(4-methoxyphenyl)-, hydrobromide structure
89972-80-5 structure
Product Name:2,2':6',2''-Terpyridine, 4'-(4-methoxyphenyl)-, hydrobromide
CAS No:89972-80-5
MF:C22H18BrN3O
MW:420.301824092865
CID:584355
PubChem ID:71327076
Update Time:2025-04-19

2,2':6',2''-Terpyridine, 4'-(4-methoxyphenyl)-, hydrobromide Chemical and Physical Properties

Names and Identifiers

    • 2,2':6',2''-Terpyridine, 4'-(4-methoxyphenyl)-, hydrobromide
    • 4-(4-methoxyphenyl)-2,6-dipyridin-2-ylpyridine,hydrobromide
    • 89972-80-5
    • 2~4~-(4-Methoxyphenyl)-1~2~,2~2~:2~6~,3~2~-terpyridine--hydrogen bromide (1/1)
    • DTXSID50756186
    • Inchi: 1S/C22H17N3O.BrH/c1-26-18-10-8-16(9-11-18)17-14-21(19-6-2-4-12-23-19)25-22(15-17)20-7-3-5-13-24-20;/h2-15H,1H3;1H
    • InChI Key: FOVASNPXEPSLKT-UHFFFAOYSA-N
    • SMILES: Br.O(C)C1C=CC(=CC=1)C1C=C(C2C=CC=CN=2)N=C(C2C=CC=CN=2)C=1

Computed Properties

  • Exact Mass: 419.06332g/mol
  • Monoisotopic Mass: 419.06332g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 4
  • Complexity: 398
  • 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: 47.9?2
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