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83425-98-3 | Benzo[f]quinoline, 1-(4-phenoxyphenyl)-3-(2-quinolinyl)-
CAS No: 83425-98-3 Catalog No: AG004VJP MDL No:
Product Description
Catalog Number:
AG004VJP
Chemical Name:
Benzo[f]quinoline, 1-(4-phenoxyphenyl)-3-(2-quinolinyl)-
CAS Number:
83425-98-3
Molecular Formula:
C34H22N2O
Molecular Weight:
474.5513
IUPAC Name:
1-(4-phenoxyphenyl)-3-quinolin-2-ylbenzo[f]quinoline
InChI:
InChI=1S/C34H22N2O/c1-2-10-26(11-3-1)37-27-18-14-24(15-19-27)29-22-33(31-20-17-25-9-5-7-13-30(25)35-31)36-32-21-16-23-8-4-6-12-28(23)34(29)32/h1-22H
InChI Key:
JZXSTRCMSWXDIH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Oc1ccc(cc1)c1cc(nc2c1c1ccccc1cc2)c1ccc2c(n1)cccc2
Properties
Complexity:
727
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
474.173g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
474.563g/mol
Monoisotopic Mass:
474.173g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.6
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