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687637-87-2 | 8-(benzyloxy)-2-phenylquinoline
CAS No: 687637-87-2 Catalog No: AG01DJPE MDL No:
Product Description
Catalog Number:
AG01DJPE
Chemical Name:
8-(benzyloxy)-2-phenylquinoline
CAS Number:
687637-87-2
Molecular Formula:
C22H17NO
Molecular Weight:
311.3765
IUPAC Name:
2-phenyl-8-phenylmethoxyquinoline
InChI:
InChI=1S/C22H17NO/c1-3-8-17(9-4-1)16-24-21-13-7-12-19-14-15-20(23-22(19)21)18-10-5-2-6-11-18/h1-15H,16H2
InChI Key:
QKWMRLHKNGTVPJ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)COc1cccc2c1nc(cc2)c1ccccc1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.131g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.384g/mol
Monoisotopic Mass:
311.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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