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833488-10-1 | 2-Propen-1-one, 3-(8-hydroxy-5-quinolinyl)-1-(4-methylphenyl)-
CAS No: 833488-10-1 Catalog No: AG004S5T MDL No:
Product Description
Catalog Number:
AG004S5T
Chemical Name:
2-Propen-1-one, 3-(8-hydroxy-5-quinolinyl)-1-(4-methylphenyl)-
CAS Number:
833488-10-1
Molecular Formula:
C19H15NO2
Molecular Weight:
289.3279
IUPAC Name:
3-(8-hydroxyquinolin-5-yl)-1-(4-methylphenyl)prop-2-en-1-one
InChI:
InChI=1S/C19H15NO2/c1-13-4-6-15(7-5-13)17(21)10-8-14-9-11-18(22)19-16(14)3-2-12-20-19/h2-12,22H,1H3
InChI Key:
UZSKNOLLNHKJTB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)C=Cc1ccc(c2c1cccn2)O
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.11g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.334g/mol
Monoisotopic Mass:
289.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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