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5825-36-5 | 8-MERCAPTOQUINOLINE-5-SULPHONIC ACID
CAS No: 5825-36-5 Catalog No: AG00EZS9 MDL No:
Product Description
Catalog Number:
AG00EZS9
Chemical Name:
8-MERCAPTOQUINOLINE-5-SULPHONIC ACID
CAS Number:
5825-36-5
IUPAC Name:
8-sulfanylquinoline-5-sulfonic acid
InChI:
InChI=1S/C9H7NO3S2/c11-15(12,13)8-4-3-7(14)9-6(8)2-1-5-10-9/h1-5,14H,(H,11,12,13)
InChI Key:
PQQNQBAMHUJCEV-UHFFFAOYSA-N
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.987g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.279g/mol
Monoisotopic Mass:
240.987g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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