| CAS Number | 2031260-86-1 |
| Catalog Number | AG01FM94(AGN-PC-3H5MCO) |
| Chemical Name | 5-Bromo-3-Iodo-4-Methylpyridin-2-Ol |
| IUPAC Name | 5-bromo-3-iodo-4-methyl-1H-pyridin-2-one |
| InChI | InChI=1S/C6H5BrINO/c1-3-4(7)2-9-6(10)5(3)8/h2H,1H3,(H,9,10) |
| InChI Key | XJOBGFGUJJFCHG-UHFFFAOYSA-N |
| MDL Number | MFCD30484393 |
| Molecular Formula | C6H5BrINO |
| Molecular Weight | 313.9185 |
| SMILES | BrC=1C(=C(C(=NC1)O)I)C |
| Synonyms | 5-bromo-3-iodo-4-methylpyridin-2-ol,
2031260-86-1,
SCHEMBL16654820,
AKOS032464716,
ZINC521396156,
F1957-0351,
|
| 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 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number