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23831-53-0 | 1H-Indeno[5,6-c]furan-1,3,5,7(6H)-tetrone, 6-(3-hydroxy-2-quinolinyl)-
CAS No: 23831-53-0 Catalog No: AG006UH5 MDL No:
Product Description
Catalog Number:
AG006UH5
Chemical Name:
1H-Indeno[5,6-c]furan-1,3,5,7(6H)-tetrone, 6-(3-hydroxy-2-quinolinyl)-
CAS Number:
23831-53-0
Molecular Formula:
C20H9NO6
Molecular Weight:
359.2886
IUPAC Name:
6-(3-hydroxyquinolin-2-yl)cyclopenta[f][2]benzofuran-1,3,5,7-tetrone
InChI:
InChI=1S/C20H9NO6/c22-14-5-8-3-1-2-4-13(8)21-16(14)15-17(23)9-6-11-12(7-10(9)18(15)24)20(26)27-19(11)25/h1-7,15,22H
InChI Key:
ZBAFBEUCTUAPFZ-UHFFFAOYSA-N
SMILES:
Oc1cc2ccccc2nc1C1C(=O)c2c(C1=O)cc1c(c2)C(=O)OC1=O
Properties
Complexity:
679
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.043g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
359.293g/mol
Monoisotopic Mass:
359.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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