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57130-91-3 | bis(5-acetyl-8-hydroxyquinolinium) sulphate
CAS No: 57130-91-3 Catalog No: AG00EPK3 MDL No:
Product Description
Catalog Number:
AG00EPK3
Chemical Name:
bis(5-acetyl-8-hydroxyquinolinium) sulphate
CAS Number:
57130-91-3
IUPAC Name:
1-(8-hydroxyquinolin-5-yl)ethanone;sulfuric acid
InChI:
InChI=1S/2C11H9NO2.H2O4S/c2*1-7(13)8-4-5-10(14)11-9(8)3-2-6-12-11;1-5(2,3)4/h2*2-6,14H,1H3;(H2,1,2,3,4)
InChI Key:
CDEWHBGYSWJUFP-UHFFFAOYSA-N
EC Number:
260-579-2
UNII:
9YSE0U52IW
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
472.094g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
472.468g/mol
Monoisotopic Mass:
472.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
183A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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