| CAS Number | 1369088-13-0 |
| Catalog Number | AG01E883(AGN-PC-0WAL0R) |
| Chemical Name | 5-Bromo-4-methoxypyridin-2-ol |
| IUPAC Name | 5-bromo-4-methoxy-1H-pyridin-2-one |
| InChI | InChI=1S/C6H6BrNO2/c1-10-5-2-6(9)8-3-4(5)7/h2-3H,1H3,(H,8,9) |
| InChI Key | IBSZUOVAWOLIED-UHFFFAOYSA-N |
| MDL Number | MFCD22057701 |
| Molecular Formula | C6H6BrNO2 |
| Molecular Weight | 204.0213 |
| SMILES | BrC=1C(=CC(=NC1)O)OC |
| Synonyms | 5-bromo-4-methoxypyridin-2-ol,
1369088-13-0,
SCHEMBL16486132,
5-bromo-4-methoxy-pyridin-2-ol,
IBSZUOVAWOLIED-UHFFFAOYSA-N,
ZINC82380804,
AKOS022693585,
5-?bromo-?4-?methoxypyridin-?2-?ol,
NE24651,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.023g/mol |
| Monoisotopic Mass | 202.958g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number