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7576-65-0 | 1H-Indene-1,3(2H)-dione, 2-(3-hydroxy-2-quinolinyl)-
CAS No: 7576-65-0 Catalog No: AG008PAX MDL No:MFCD00266981
Product Description
Catalog Number:
AG008PAX
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(3-hydroxy-2-quinolinyl)-
CAS Number:
7576-65-0
Molecular Formula:
C18H11NO3
Molecular Weight:
289.2848
MDL Number:
MFCD00266981
IUPAC Name:
2-(3-hydroxyquinolin-2-yl)indene-1,3-dione
InChI:
InChI=1S/C18H11NO3/c20-14-9-10-5-1-4-8-13(10)19-16(14)15-17(21)11-6-2-3-7-12(11)18(15)22/h1-9,15,20H
InChI Key:
FDTLQXNAPKJJAM-UHFFFAOYSA-N
SMILES:
Oc1cc2ccccc2nc1C1C(=O)c2c(C1=O)cccc2
UNII:
U69Y4Q67LZ
NSC Number:
64849
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.074g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.29g/mol
Monoisotopic Mass:
289.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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