| CAS Number | 1803589-78-7 |
| Catalog Number | AG01BE7N(AGN-PC-0WOVIP) |
| Chemical Name | 4-Bromo-5-methoxy-2-methylpyridine hydrochloride |
| IUPAC Name | 4-bromo-5-methoxy-2-methylpyridine;hydrochloride |
| InChI | InChI=1S/C7H8BrNO.ClH/c1-5-3-6(8)7(10-2)4-9-5;/h3-4H,1-2H3;1H |
| InChI Key | ACHQDRWRZNUQIF-UHFFFAOYSA-N |
| MDL Number | MFCD28063981 |
| Molecular Formula | C7H9BrClNO |
| Molecular Weight | 238.5095 |
| SMILES | Cl.COC1=C(Br)C=C(C)N=C1 |
| Synonyms | 4-Bromo-5-methoxy-2-methylpyridine hydrochloride,
1803589-78-7,
AKOS026744540,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.509g/mol |
| Monoisotopic Mass | 236.956g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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