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23003-22-7 | 2(1H)-Pyridinethione, 3-hydroxy-
CAS No: 23003-22-7 Catalog No: AG002LUB MDL No:MFCD00006286
Product Description
Catalog Number:
AG002LUB
Chemical Name:
2(1H)-Pyridinethione, 3-hydroxy-
CAS Number:
23003-22-7
Molecular Formula:
C5H5NOS
Molecular Weight:
127.1643
MDL Number:
MFCD00006286
IUPAC Name:
3-hydroxy-1H-pyridine-2-thione
InChI:
InChI=1S/C5H5NOS/c7-4-2-1-3-6-5(4)8/h1-3,7H,(H,6,8)
InChI Key:
MARYDOMJDFATPK-UHFFFAOYSA-N
SMILES:
S=c1[nH]cccc1O
EC Number:
245-375-3
UNII:
M8U5Q5R3SA
NSC Number:
283470
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.009g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
127.161g/mol
Monoisotopic Mass:
127.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Spectroscopic studies of intramolecular proton transfer in 2-(4-fluorophenylamino)-5-(2,4-dihydroxybenzeno)-1,3,4-thiadiazole. | Journal of fluorescence 20110101 |
| Metallo-graphene nanocomposite electrocatalytic platform for the determination of toxic metal ions. | Sensors (Basel, Switzerland) 20110101 |
| Theoretical studies on sulfur and metal cation (Cu(II), Ni(II), Pd(II), and Pt(II))-containing artificial DNA. | The journal of physical chemistry. B 20090924 |
| Soft metal-mediated base pairing with novel synthetic nucleosides possessing an O,S-donor ligand. | The Journal of organic chemistry 20080815 |
| Model complexes of cobalt-substituted matrix metalloproteinases: tools for inhibitor design. | Inorganic chemistry 20060904 |
| Synthesis, structure and spectroscopy of new thiopyrone and hydroxypyridinethione transition-metal complexes. | Dalton transactions (Cambridge, England : 2003) 20050807 |
| A theoretical study of solvent effects on tautomerism and electronic absorption spectra of 3-hydroxy-2-mercaptopyridine and 2,3-dihydroxypyridine. | Journal of computational chemistry 20041130 |
| Addressing lead toxicity: complexation of lead(II) with thiopyrone and hydroxypyridinethione O,S mixed chelators. | Inorganic chemistry 20041018 |
| New beginnings for matrix metalloproteinase inhibitors: identification of high-affinity zinc-binding groups. | Journal of the American Chemical Society 20040714 |
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