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Home > Pyridines > 287472-59-7
287472-59-7 | 2,2':6',2''-Terpyridine, 4'-(1-pyrenyl)-
CAS No: 287472-59-7 Catalog No: AG002WBX MDL No:
Product Description
Catalog Number:
AG002WBX
Chemical Name:
2,2':6',2''-Terpyridine, 4'-(1-pyrenyl)-
CAS Number:
287472-59-7
Molecular Formula:
C31H19N3
Molecular Weight:
433.5027
IUPAC Name:
4-pyren-1-yl-2,6-dipyridin-2-ylpyridine
InChI:
InChI=1S/C31H19N3/c1-3-16-32-26(8-1)28-18-23(19-29(34-28)27-9-2-4-17-33-27)24-14-12-22-11-10-20-6-5-7-21-13-15-25(24)31(22)30(20)21/h1-19H
InChI Key:
QRJVEKYHTAKHCW-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)c1nc(cc(c1)c1ccc2c3c1ccc1c3c(cc2)ccc1)c1ccccn1
Properties
Complexity:
668
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
433.158g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
433.514g/mol
Monoisotopic Mass:
433.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
Literature
| Title | Journal |
|---|---|
| Cobalt(II) complexes of terpyridine bases as photochemotherapeutic agents showing cellular uptake and photocytotoxicity in visible light. | Dalton transactions (Cambridge, England : 2003) 20110214 |
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