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2149-36-2 | 8-Quinolinol,8-(hydrogen sulfate)
CAS No: 2149-36-2 Catalog No: AG00711Y MDL No:
Product Description
Catalog Number:
AG00711Y
Chemical Name:
8-Quinolinol,8-(hydrogen sulfate)
CAS Number:
2149-36-2
Molecular Formula:
C9H7NO4S
Molecular Weight:
225.2212
IUPAC Name:
quinolin-8-yl hydrogen sulfate
InChI:
InChI=1S/C9H7NO4S/c11-15(12,13)14-8-5-1-3-7-4-2-6-10-9(7)8/h1-6H,(H,11,12,13)
InChI Key:
LZWNCISSBNEUOF-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)Oc1cccc2c1nccc2
EC Number:
218-417-3
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.01g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.218g/mol
Monoisotopic Mass:
225.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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