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29021-67-8 | 5-Quinolinesulfonic acid, 8-hydroxy-2-methyl-
CAS No: 29021-67-8 Catalog No: AG002V8Y MDL No:
Product Description
Catalog Number:
AG002V8Y
Chemical Name:
5-Quinolinesulfonic acid, 8-hydroxy-2-methyl-
CAS Number:
29021-67-8
Molecular Formula:
C10H9NO4S
Molecular Weight:
239.2478
IUPAC Name:
8-hydroxy-2-methylquinoline-5-sulfonic acid
InChI:
InChI=1S/C10H9NO4S/c1-6-2-3-7-9(16(13,14)15)5-4-8(12)10(7)11-6/h2-5,12H,1H3,(H,13,14,15)
InChI Key:
RDYCCKHYFOQHOD-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(n1)c(O)ccc2S(=O)(=O)O
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.245g/mol
Monoisotopic Mass:
239.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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