| CAS Number | 1410164-87-2 |
| Catalog Number | AG01FR3F(AGN-PC-3H5PF6) |
| Chemical Name | 3-Benzyloxy-2-bromo-5-chloro-pyrazine |
| IUPAC Name | 2-bromo-5-chloro-3-phenylmethoxypyrazine |
| InChI | InChI=1S/C11H8BrClN2O/c12-10-11(15-9(13)6-14-10)16-7-8-4-2-1-3-5-8/h1-6H,7H2 |
| InChI Key | KLQXUNMUQOFZDO-UHFFFAOYSA-N |
| Molecular Formula | C11H8BrClN2O |
| Molecular Weight | 299.5510 |
| SMILES | |
| Synonyms | 3-(benzyloxy)-2-bromo-5-chloropyrazine,
1410164-87-2,
|
| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.95085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 299.55g/mol |
| Monoisotopic Mass | 297.95085g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number