| CAS Number | 1121634-68-1 |
| Catalog Number | AG01B5M9 |
| Chemical Name | 2-bromo-5-[(3-chlorophenyl)methoxy]pyridine |
| IUPAC Name | 2-bromo-5-[(3-chlorophenyl)methoxy]pyridine |
| InChI | InChI=1S/C12H9BrClNO/c13-12-5-4-11(7-15-12)16-8-9-2-1-3-10(14)6-9/h1-7H,8H2 |
| InChI Key | SXZARDINRZKTGF-UHFFFAOYSA-N |
| MDL Number | MFCD11874743 |
| Molecular Formula | C12H9BrClNO |
| Molecular Weight | 298.563 |
| SMILES | ClC1=CC(COC2=CN=C(Br)C=C2)=CC=C1 |
| Synonyms | 2-bromo-5-[(3-chlorophenyl)methoxy]pyridine,
1121634-68-1,
ZINC96303039,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 296.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.564g/mol |
| Monoisotopic Mass | 296.956g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number