| CAS Number | 851607-30-2 |
| Catalog Number | AG00G8DP(AGN-PC-03ZKU5) |
| Chemical Name | 3-Bromo-5-chloro-2-methoxy-4-methylpyridine |
| IUPAC Name | 3-bromo-5-chloro-2-methoxy-4-methylpyridine |
| InChI | InChI=1S/C7H7BrClNO/c1-4-5(9)3-10-7(11-2)6(4)8/h3H,1-2H3 |
| InChI Key | CRWBHPSHBRYYIS-UHFFFAOYSA-N |
| MDL Number | MFCD17014980 |
| Molecular Formula | C7H7BrClNO |
| Molecular Weight | 236.4936 |
| SMILES | COC1=NC=C(Cl)C(C)=C1Br |
| Synonyms | 3-Bromo-5-chloro-2-methoxy-4-methylpyridine,
851607-30-2,
SCHEMBL676712,
DTXSID20630888,
CRWBHPSHBRYYIS-UHFFFAOYSA-N,
MFCD17014980,
ZINC59689066,
FCH1351878,
AS-49400,
OR345528,
AJ-113595,
AX8258883,
Pyridine, 3-bromo-5-chloro-2-methoxy-4-methyl-,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.493g/mol |
| Monoisotopic Mass | 234.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number