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2,6-Bis(2-Pyridyl)-4(1H)-Pyridone

Catalog Number
ACM128143884-2
Product Name
2,6-Bis(2-Pyridyl)-4(1H)-Pyridone
Structure
CAS
128143-88-4
Category
Nitrogen-containing MOF ligand-binary nitrogen-containing MOF ligand
Synonyms
1'H-[2,2'; 2,6-Bis(2-pyridyl)-4(1H)-pyridone, 98%; KS-00000USR; [2,2':6',2''-Terpyridin]-4'(1'H)-one; AKOS015914629; ANW-19055; SY052797; SCHEMBL1988750; CHEMBL2205804; MFCD01321386 (97%);
IUPAC Name
2,6-dipyridin-2-yl-1H-pyridin-4-one
Molecular Weight
249.27g/mol
Molecular Formula
C15H11N3O
Canonical SMILES
C1=CC=NC(=C1)C2=CC(=O)C=C(N2)C3=CC=CC=N3;
InChI
InChI=1S/C15H11N3O/c19-11-9-14(12-5-1-3-7-16-12)18-15(10-11)13-6-2-4-8-17-13/h1-10H,(H,18,19)
InChI Key
HRORSVNZQWCZTD-UHFFFAOYSA-N
Complexity
378
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
249.090211983g/mol
Formal Charge
0
Heavy Atom Count
19
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
249.090211983g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
54.9Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.3
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