| CAS Number | 94135-59-8 |
| Catalog Number | AG006R4D(AGN-PC-0W3SAS) |
| Chemical Name | 5-Chloro-3-methoxypyridin-2-ol |
| EC Number | 302-928-4 |
| IUPAC Name | 5-chloro-3-methoxy-1H-pyridin-2-one |
| InChI | InChI=1S/C6H6ClNO2/c1-10-5-2-4(7)3-8-6(5)9/h2-3H,1H3,(H,8,9) |
| InChI Key | YERTYULGRITLAF-UHFFFAOYSA-N |
| MDL Number | MFCD18415703 |
| Molecular Formula | C6H6ClNO2 |
| Molecular Weight | 159.5703 |
| SMILES | COc1cc(Cl)c[nH]c1=O |
| Synonyms | 5-Chloro-3-methoxy-1H-pyridin-2-one,
94135-59-8,
5-Chloro-3-methoxypyridin-2-ol,
EINECS 302-928-4,
AC1MIF6V,
CTK5H5319,
DTXSID00240762,
ZINC33637141,
5-Chloro-3-methoxy-2(1H)-pyridone,
5-Chloro-2-hydroxy-3-methoxypyridine,
C6H6ClNO2,
C6-H6-Cl-N-O2,
CID3023720,
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| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.569g/mol |
| Monoisotopic Mass | 159.009g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number