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| CAS Number | 1121-31-9 |
| Catalog Number | AG003HX6(AGN-PC-0NXU8N) |
| Chemical Name | 2-PYRIDINETHIOL 1-OXIDE |
| IUPAC Name | 1-hydroxypyridine-2-thione |
| InChI | InChI=1S/C5H5NOS/c7-6-4-2-1-3-5(6)8/h1-4,7H |
| InChI Key | YBBJKCMMCRQZMA-UHFFFAOYSA-N |
| MDL Number | MFCD00006196 |
| Molecular Formula | C5H5NOS |
| Molecular Weight | 127.1643 |
| NSC Number | 179790 |
| SMILES | Sc1n(=O)cccc1 |
| UNII | 6GK82EC25D |
| Synonyms | 1-hydroxypyridine-2-thione,
2-HPT cpd,
2-mercaptopyridine-N-oxide,
2-pyridinethiol 1-oxide,
67Ga-MPO,
68Ga-mercaptopyridine-N-oxide,
indium 111-2-mercaptopyridine-1-oxide,
N-hydroxypyridine-2-thione,
Omadine,
pyridine-2-thiol N-oxide,
pyrithione,
pyrithione barium (2:1) salt,
pyrithione calcium (2:1) salt,
pyrithione magnesium salt,
pyrithione potassium salt,
pyrithione sodium salt,
sodium pyridinethione,
pyrithione,
1121-31-9,
2-MERCAPTOPYRIDINE-N-OXIDE,
2-mercaptopyridine n-oxide,
1-Hydroxy-2-pyridinethione,
Omadine,
2-Pyridinethiol, 1-oxide,
1121-30-8,
1-hydroxypyridine-2-thione,
1-Hydroxyl-1H-pyridine-2-thione,
N-Hydroxypyridine-2-thione,
2-Pyridinethiol 1-oxide,
Pyridine-2-thiol N-oxide,
1-Hydroxy-2(1H)-pyridinethione,
2-Mercaptopyridine monoxide,
SQ 2113,
1-Hydroxy-2-(1H)-pyridinethione,
2-MERCAPTOPYRIDINE 1-OXIDE,
UNII-6GK82EC25D,
MFCD00006196,
2-Pyridinethiol-1-oxide,
EINECS 214-328-9,
EINECS 214-329-4,
pyridine-2-thiol 1-oxide,
NSC 179790,
1-oxidanylpyridine-2-thione,
BRN 0109936,
BRN 0906983,
2-SULFANYLPYRIDIN-1-IUM-1-OLATE,
AI3-60234,
MLS001335994,
6GK82EC25D,
CHEMBL1356238,
CHEBI:36578,
CHEBI:36584,
1-hydroxypyridine-2(1H)-thione,
NSC179790,
2-(1H)-Pyridinethione, 1-hydroxy-,
1-hydroxy-1,2-dihydropyridine-2-thione,
SMR000814708,
2-sulfanylpyridin-1-ol,
W-108657,
2-Mercaptopyridine-N-oxide, 99%,
sodium pyridinethione,
2-HPT cpd,
304675-78-3,
67Ga-MPO,
Pyridine-2-thiol-1-oxide,
Pyrithion,
68Ga-mercaptopyridine-N-oxide,
1-hydroxy-1H-pyridine-2-thione,
1-hydroxy- 2(1H)-pyridinethione,
BEW,
2(1H)-Pyridinethione, 1-hydroxy-,
indium 111-2-mercaptopyridine-1-oxide,
2-Pyridinethiol1-oxide,
ACMC-1BNPO,
mercaptopyridine-1-oxide,
2-pyridinethiol-N-oxide,
2-Thiopyridine-N-oxide-,
mercapto pyridine-1-oxide,
2-mercaptopyridine-1-oxid,
2mercapto pyridine N-oxide,
2-Mercaptopyridine-1-oxide,
2-Thiolatopyridine 1-oxide,
AC1L1BR9,
cid_1570,
WLN: T6NYJ AQ BUS,
2-mercapto pyridine N-oxide,
2-mercapto-pyridine-N-oxide,
2-mercapto-pyridine-1-oxide,
SCHEMBL24755,
SCHEMBL49266,
5-21-07-00150 (Beilstein Handbook Reference),
MLS001335993,
1-oxidopyridin-1-ium-2-thiol,
Jsp000926,
CHEMBL1650619,
BDBM60985,
CTK4A7674,
CTK8A9254,
YBBJKCMMCRQZMA-UHFFFAOYSA-,
1-Oxido-2-pyridinyl hydrosulfide,
FGVVTMRZYROCTH-UHFFFAOYSA-N,
YBBJKCMMCRQZMA-UHFFFAOYSA-N,
HMS1772L20,
ZINC156822,
2(1H)-Pyridinethione,1-hydroxy-,
2-Mercaptopyridine N-oxide, 99%,
ANW-16395,
BBL104003,
BDBM50366038,
FCH834502,
SBB065304,
STL557814,
ZINC13524343,
AKOS001147723,
AKOS006239794,
AB00615,
NE10429,
NSC-179790,
SB21519,
VP14325,
NCGC00246995-01,
AN-48587,
AS-10952,
HC150162,
SC-46446,
SC-88136,
AB0008461,
DB-038047,
LS-132085,
LS-132097,
TX-012976,
FT-0612771,
ST51015017,
A802495,
A802496,
I02-0694,
J-002710,
InChI=1/C5H5NOS/c7-6-4-2-1-3-5(6)8/h1-4,7H,
C5H5NOS,
Pyrithione sodium salt,
pyrithione magnesium salt,
pyrithione potassium salt,
1-Hydroxy-2-Sulfanylpyridinium,
pyrithione barium (2:1) salt,
HYDROXY 2-PYRIDINETHIONE,
pyrithione calcium (2:1) salt,
C5-H5-N-O-S,
CID1570,
2-Mercaptopyridine N-oxide, 96% - 1G 1g,
H0302,
2-Mercaptopyridine-N-oxide sodium salt hydrate,
C008704,
15922-78-8,
PTO,
|
| Complexity | 162 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 127.161g/mol |
| Monoisotopic Mass | 127.009g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
| Symbol: | |
| Hazard Class | 9 |
| Hazard statements | H302+H312+H332-H315-H319 |
| Packing Group | Ⅲ |
| Precautionary statements | P501-P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312-P304+P340+P312 |
| UN Code | UN 3335 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
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| Test: | Result: |

