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Structure

2,5-Bis(4-Pyridyl)-1,3,4-Oxadiazole

CAS
15420-02-7
Catalog Number
ACM15420027
Category
Other Products
Molecular Weight
224.22
Molecular Formula
C12H8N4O

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Specification

Synonyms
4,4(1,3,4-OXADIAZOLE-2,5-DIYL)BIS-PYRIDINE;2,5-BIS(4-PYRIDYL)-1,3,4-OXADIAZOLE
IUPAC Name
2,5-dipyridin-4-yl-1,3,4-oxadiazole
InChI
InChI=1S/C12H8N4O/c1-5-13-6-2-9(1)11-15-16-12(17-11)10-3-7-14-8-4-10/h1-8H
InChI Key
FFGFSQOCKQVECP-UHFFFAOYSA-N
Complexity
215
CompoundIs Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
224.06981089g/mol
Formal Charge
0
Heavy Atom Count
17
Hydrogen Bond Acceptor Count
5
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
224.06981089g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
64.7Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
0.9
June 16, 2023


Good ligand
The ligand formed by 2,5-bis(4-pyridyl)-1,3,4-oxadiazole and metal ions is very stable.

Upstream Synthesis Route 1

  • 4813-04-1
  • 15420-02-7

Reference: [1]Sagitullin; Kost
[Vestnik Moskovskogo Universiteta, 1959, vol. 14, # 4, p. 187,190][Chem.Abstr., 1960, p. 17383]

Upstream Synthesis Route 2

  • 4329-75-3
  • 15420-02-7

Reference: [1]Libman; Slack
[Journal of the Chemical Society, 1956, p. 2253,2257]

Upstream Synthesis Route 3

  • 55-22-1
  • 54-85-3
  • 15420-02-7

Reference: [1]Pachhamia; Parikh
[Journal of the Indian Chemical Society, 1989, vol. 66, # 4, p. 250 - 251]

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