| CAS Number | 1949816-03-8 |
| Catalog Number | AG01FM7H(AGN-PC-3H5MB5) |
| Chemical Name | 5-bromo-3-iodo-6-methylpyridin-2-ol |
| IUPAC Name | 5-bromo-3-iodo-6-methyl-1H-pyridin-2-one |
| InChI | InChI=1S/C6H5BrINO/c1-3-4(7)2-5(8)6(10)9-3/h2H,1H3,(H,9,10) |
| InChI Key | JDUDDYRMKFBMPJ-UHFFFAOYSA-N |
| MDL Number | MFCD29999495 |
| Molecular Formula | C6H5BrINO |
| Molecular Weight | 313.9185 |
| SMILES | BrC=1C=C(C(=NC1C)O)I |
| Synonyms | 5-bromo-3-iodo-6-methylpyridin-2-ol,
1949816-03-8,
AKOS026700119,
ZINC409421775,
F1957-0302,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 312.86g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 313.92g/mol |
| Monoisotopic Mass | 312.86g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number