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3039-74-5 | 4-Quinolinol, 1-oxide
CAS No: 3039-74-5 Catalog No: AG002ZYS MDL No:
Product Description
Catalog Number:
AG002ZYS
Chemical Name:
4-Quinolinol, 1-oxide
CAS Number:
3039-74-5
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
IUPAC Name:
1-hydroxyquinolin-4-one
InChI:
InChI=1S/C9H7NO2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H
InChI Key:
AJTLULFWRGRNEZ-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(c2c1cccc2)O
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Synthesis and antibacterial activity of 2-substituted 6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acids. | Farmaco (Societa chimica italiana : 1989) 20010901 |
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