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Home > Pyridines > 157557-32-9
157557-32-9 | 2,2':6',2''-Terpyridine, 4'-[4-(1,1-dimethylethyl)phenyl]-
CAS No: 157557-32-9 Catalog No: AG001PIB MDL No:
Product Description
Catalog Number:
AG001PIB
Chemical Name:
2,2':6',2''-Terpyridine, 4'-[4-(1,1-dimethylethyl)phenyl]-
CAS Number:
157557-32-9
Molecular Formula:
C25H23N3
Molecular Weight:
365.4702
IUPAC Name:
4-(4-tert-butylphenyl)-2,6-dipyridin-2-ylpyridine
InChI:
InChI=1S/C25H23N3/c1-25(2,3)20-12-10-18(11-13-20)19-16-23(21-8-4-6-14-26-21)28-24(17-19)22-9-5-7-15-27-22/h4-17H,1-3H3
InChI Key:
ISSJWXXXHPZTPN-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)c1cc(nc(c1)c1ccccn1)c1ccccn1)(C)C
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.189g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
365.48g/mol
Monoisotopic Mass:
365.189g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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