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Home > Quinoline > 656234-03-6
656234-03-6 | 5-Isoquinolinol, 4-[1,1'-biphenyl]-3-yl-1-methoxy-
CAS No: 656234-03-6 Catalog No: AG006QIU MDL No:
Product Description
Catalog Number:
AG006QIU
Chemical Name:
5-Isoquinolinol, 4-[1,1'-biphenyl]-3-yl-1-methoxy-
CAS Number:
656234-03-6
Molecular Formula:
C22H17NO2
Molecular Weight:
327.3759
IUPAC Name:
1-methoxy-4-(3-phenylphenyl)isoquinolin-5-ol
InChI:
InChI=1S/C22H17NO2/c1-25-22-18-11-6-12-20(24)21(18)19(14-23-22)17-10-5-9-16(13-17)15-7-3-2-4-8-15/h2-14,24H,1H3
InChI Key:
SVWCTRMNYHZZSB-UHFFFAOYSA-N
SMILES:
COc1ncc(c2c1cccc2O)c1cccc(c1)c1ccccc1
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.383g/mol
Monoisotopic Mass:
327.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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