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Home > Quinoline > 137731-79-4
137731-79-4 | Quinoline, 2,2'-(2,6-pyridinediyl)bis[4-phenyl-
CAS No: 137731-79-4 Catalog No: AG0013RU MDL No:
Product Description
Catalog Number:
AG0013RU
Chemical Name:
Quinoline, 2,2'-(2,6-pyridinediyl)bis[4-phenyl-
CAS Number:
137731-79-4
Molecular Formula:
C35H23N3
Molecular Weight:
485.5772
IUPAC Name:
4-phenyl-2-[6-(4-phenylquinolin-2-yl)pyridin-2-yl]quinoline
InChI:
InChI=1S/C35H23N3/c1-3-12-24(13-4-1)28-22-34(36-30-18-9-7-16-26(28)30)32-20-11-21-33(38-32)35-23-29(25-14-5-2-6-15-25)27-17-8-10-19-31(27)37-35/h1-23H
InChI Key:
IXEYENWVSDWONT-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cc(nc2c1cccc2)c1cccc(n1)c1nc2ccccc2c(c1)c1ccccc1
Properties
Complexity:
682
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
485.189g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
485.59g/mol
Monoisotopic Mass:
485.189g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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