| CAS Number | 1227580-80-4 |
| Catalog Number | AG009WRA(AGN-PC-0WO2DI) |
| Chemical Name | 2-Chloro-5-methylpyridin-4-ol |
| IUPAC Name | 2-chloro-5-methyl-1H-pyridin-4-one |
| InChI | InChI=1S/C6H6ClNO/c1-4-3-8-6(7)2-5(4)9/h2-3H,1H3,(H,8,9) |
| InChI Key | GOUISLIKOIBJMR-UHFFFAOYSA-N |
| MDL Number | MFCD16610469 |
| Molecular Formula | C6H6ClNO |
| Molecular Weight | 143.5709 |
| SMILES | Clc1ncc(c(c1)O)C |
| Synonyms | 2-chloro-5-methylpyridin-4-ol,
1227580-80-4,
2-CHLORO-4-HYDROXY-5-METHYLPYRIDINE,
SCHEMBL17703502,
ZINC90225727,
AKOS017516437,
AB71181,
NE54179,
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| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.57g/mol |
| Monoisotopic Mass | 143.014g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
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