| CAS Number | 1211536-99-0 |
| Catalog Number | AG01AFMP(AGN-PC-0WO9DC) |
| Chemical Name | 5-Bromo-3-(difluoromethoxy)-2-methylpyridine |
| IUPAC Name | 5-bromo-3-(difluoromethoxy)-2-methylpyridine |
| InChI | InChI=1S/C7H6BrF2NO/c1-4-6(12-7(9)10)2-5(8)3-11-4/h2-3,7H,1H3 |
| InChI Key | BSSKMVWHRJFVNT-UHFFFAOYSA-N |
| MDL Number | MFCD18260134 |
| Molecular Formula | C7H6BrF2NO |
| Molecular Weight | 238.0294 |
| SMILES | CC1=C(OC(F)F)C=C(Br)C=N1 |
| Synonyms | 5-bromo-3-(difluoromethoxy)-2-methylpyridine,
1211536-99-0,
ZINC95883930,
AKOS026729107,
NE61702,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.032g/mol |
| Monoisotopic Mass | 236.96g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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Certificate of Analysis
Lot Number