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797039-83-9 | Quinolinium, 6-hydroxy-1,2-dimethyl-, iodide
CAS No: 797039-83-9 Catalog No: AG0050UN MDL No:
Product Description
Catalog Number:
AG0050UN
Chemical Name:
Quinolinium, 6-hydroxy-1,2-dimethyl-, iodide
CAS Number:
797039-83-9
Molecular Formula:
C11H12INO
Molecular Weight:
301.1236
IUPAC Name:
1,2-dimethylquinolin-1-ium-6-ol;iodide
InChI:
InChI=1S/C11H11NO.HI/c1-8-3-4-9-7-10(13)5-6-11(9)12(8)2;/h3-7H,1-2H3;1H
InChI Key:
YYMPCKJYPUTOIW-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)ccc([n+]2C)C.[I-]
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.996g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.127g/mol
Monoisotopic Mass:
300.996g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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