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34006-16-1 | 8-Mercaptoquinoline hydrochloride
CAS No: 34006-16-1 Catalog No: AG0034ER MDL No:MFCD00043261
Product Description
Catalog Number:
AG0034ER
Chemical Name:
8-Mercaptoquinoline hydrochloride
CAS Number:
34006-16-1
Molecular Formula:
C9H8ClNS
Molecular Weight:
197.6845
MDL Number:
MFCD00043261
IUPAC Name:
quinoline-8-thiol;hydrochloride
InChI:
InChI=1S/C9H7NS.ClH/c11-8-5-1-3-7-4-2-6-10-9(7)8;/h1-6,11H;1H
InChI Key:
RWBSBQAUAJSGHY-UHFFFAOYSA-N
SMILES:
Sc1cccc2c1nccc2.Cl
EC Number:
251-785-3
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.007g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
197.68g/mol
Monoisotopic Mass:
197.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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