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83609-87-4 | 2(1H)-Quinolinone,4-hydroxy-7-methyl-3-phenyl-
CAS No: 83609-87-4 Catalog No: AG008IWT MDL No:MFCD00100772
Product Description
Catalog Number:
AG008IWT
Chemical Name:
2(1H)-Quinolinone,4-hydroxy-7-methyl-3-phenyl-
CAS Number:
83609-87-4
Molecular Formula:
C16H13NO2
Molecular Weight:
251.2799
MDL Number:
MFCD00100772
IUPAC Name:
4-hydroxy-7-methyl-3-phenyl-1H-quinolin-2-one
InChI:
InChI=1S/C16H13NO2/c1-10-7-8-12-13(9-10)17-16(19)14(15(12)18)11-5-3-2-4-6-11/h2-9H,1H3,(H2,17,18,19)
InChI Key:
WEKPPTVMVCXCNH-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)[nH]c(=O)c(c2O)c1ccccc1
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.285g/mol
Monoisotopic Mass:
251.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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