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14300-12-0 | Quinoline,2,4-dimethyl-, 1-oxide
CAS No: 14300-12-0 Catalog No: AG007Z6H MDL No:
Product Description
Catalog Number:
AG007Z6H
Chemical Name:
Quinoline,2,4-dimethyl-, 1-oxide
CAS Number:
14300-12-0
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
IUPAC Name:
2,4-dimethyl-1-oxidoquinolin-1-ium
InChI:
InChI=1S/C11H11NO/c1-8-7-9(2)12(13)11-6-4-3-5-10(8)11/h3-7H,1-2H3
InChI Key:
KZZPVCLLJFIKNX-UHFFFAOYSA-N
SMILES:
[O-][n+]1c(C)cc(c2c1cccc2)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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