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14300-11-9 | Quinoline, 2,3-dimethyl-, 1-oxide
CAS No: 14300-11-9 Catalog No: AG007KHR MDL No:
Product Description
Catalog Number:
AG007KHR
Chemical Name:
Quinoline, 2,3-dimethyl-, 1-oxide
CAS Number:
14300-11-9
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
IUPAC Name:
2,3-dimethyl-1-oxidoquinolin-1-ium
InChI:
InChI=1S/C11H11NO/c1-8-7-10-5-3-4-6-11(10)12(13)9(8)2/h3-7H,1-2H3
InChI Key:
WBLLAYDCFPAIPX-UHFFFAOYSA-N
SMILES:
Cc1cc2ccccc2[n+](c1C)[O-]
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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