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84376-52-3 | 4-Quinolinol, 2,6-dimethyl-, 1-oxide
CAS No: 84376-52-3 Catalog No: AG004X6D MDL No:
Product Description
Catalog Number:
AG004X6D
Chemical Name:
4-Quinolinol, 2,6-dimethyl-, 1-oxide
CAS Number:
84376-52-3
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
IUPAC Name:
1-hydroxy-2,6-dimethylquinolin-4-one
InChI:
InChI=1S/C11H11NO2/c1-7-3-4-10-9(5-7)11(13)6-8(2)12(10)14/h3-6,14H,1-2H3
InChI Key:
JVDKQDJRVWANOV-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(O)cc([n+]2[O-])C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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