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Home > Pyridines > 145221-57-4
145221-57-4 | Pyridine, 2,2'-(1,3-phenylene)bis[4,6-diphenyl- (9CI)
CAS No: 145221-57-4 Catalog No: AG001KNY MDL No:
Product Description
Catalog Number:
AG001KNY
Chemical Name:
Pyridine, 2,2'-(1,3-phenylene)bis[4,6-diphenyl- (9CI)
CAS Number:
145221-57-4
Molecular Formula:
C40H28N2
Molecular Weight:
536.6637
IUPAC Name:
2-[3-(4,6-diphenylpyridin-2-yl)phenyl]-4,6-diphenylpyridine
InChI:
InChI=1S/C40H28N2/c1-5-14-29(15-6-1)35-25-37(31-18-9-3-10-19-31)41-39(27-35)33-22-13-23-34(24-33)40-28-36(30-16-7-2-8-17-30)26-38(42-40)32-20-11-4-12-21-32/h1-28H
InChI Key:
VSHGZMKPIKEHJF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cc(nc(c1)c1ccccc1)c1cccc(c1)c1cc(cc(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
722
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.225g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
536.678g/mol
Monoisotopic Mass:
536.225g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.7
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