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825620-17-5 | 4-Quinolinol, 7,8-dimethoxy-2-phenyl-
CAS No: 825620-17-5 Catalog No: AG005DTQ MDL No:
Product Description
Catalog Number:
AG005DTQ
Chemical Name:
4-Quinolinol, 7,8-dimethoxy-2-phenyl-
CAS Number:
825620-17-5
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
IUPAC Name:
7,8-dimethoxy-2-phenyl-1H-quinolin-4-one
InChI:
InChI=1S/C17H15NO3/c1-20-15-9-8-12-14(19)10-13(11-6-4-3-5-7-11)18-16(12)17(15)21-2/h3-10H,1-2H3,(H,18,19)
InChI Key:
FCXNUDGSCPEJRY-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc2c1nc(cc2O)c1ccccc1
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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