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Home > Pyridines > 167412-36-4
167412-36-4 | Pyrimidine, 4,6-bis([2,2'-bipyridin]-6-yl)-
CAS No: 167412-36-4 Catalog No: AG001XDI MDL No:
Product Description
Catalog Number:
AG001XDI
Chemical Name:
Pyrimidine, 4,6-bis([2,2'-bipyridin]-6-yl)-
CAS Number:
167412-36-4
Molecular Formula:
C24H16N6
Molecular Weight:
388.4240
IUPAC Name:
4,6-bis(6-pyridin-2-ylpyridin-2-yl)pyrimidine
InChI:
InChI=1S/C24H16N6/c1-3-13-25-17(7-1)19-9-5-11-21(29-19)23-15-24(28-16-27-23)22-12-6-10-20(30-22)18-8-2-4-14-26-18/h1-16H
InChI Key:
YWDAHRHRZBYXOD-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)c1cccc(n1)c1ncnc(c1)c1cccc(n1)c1ccccn1
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.144g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.434g/mol
Monoisotopic Mass:
388.144g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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