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27669-24-5 | 3-Acetyl-2-methylquinoline 1-oxide
CAS No: 27669-24-5 Catalog No: AG00BKDG MDL No:
Product Description
Catalog Number:
AG00BKDG
Chemical Name:
3-Acetyl-2-methylquinoline 1-oxide
CAS Number:
27669-24-5
IUPAC Name:
1-(2-methyl-1-oxidoquinolin-1-ium-3-yl)ethanone
InChI:
InChI=1S/C12H11NO2/c1-8-11(9(2)14)7-10-5-3-4-6-12(10)13(8)15/h3-7H,1-2H3
InChI Key:
CUOGLZASDQWJRW-UHFFFAOYSA-N
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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