| CAS Number | 1824270-14-5 |
| Catalog Number | AG01CAAV |
| Chemical Name | 6-Bromo-8-Chloroisoquinoline |
| IUPAC Name | 6-bromo-8-chloroisoquinoline |
| InChI | InChI=1S/C9H5BrClN/c10-7-3-6-1-2-12-5-8(6)9(11)4-7/h1-5H |
| InChI Key | BTLUGEXANPINDI-UHFFFAOYSA-N |
| MDL Number | MFCD28129772 |
| Molecular Formula | C9H5BrClN |
| Molecular Weight | 242.4997 |
| SMILES | ClC1=CC(Br)=CC2=C1C=NC=C2 |
| Synonyms | 6-bromo-8-chloroisoquinoline,
1824270-14-5,
AKOS034086512,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.929g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.5g/mol |
| Monoisotopic Mass | 240.929g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number