| CAS Number | 36739-97-6 |
| Catalog Number | AG01B5LW |
| Chemical Name | 3-Bromo-6-chloro-1-benzofuran |
| IUPAC Name | 3-bromo-6-chloro-1-benzofuran |
| InChI | InChI=1S/C8H4BrClO/c9-7-4-11-8-3-5(10)1-2-6(7)8/h1-4H |
| InChI Key | LFZQZEPSLRZJSA-UHFFFAOYSA-N |
| MDL Number | MFCD22560102 |
| Molecular Formula | C8H4BrClO |
| Molecular Weight | 231.4738 |
| SMILES | ClC1=CC2=C(C(=CO2)Br)C=C1 |
| Synonyms | 3-bromo-6-chloro-1-benzofuran,
36739-97-6,
ZINC82345172,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.913g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.473g/mol |
| Monoisotopic Mass | 229.913g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 13.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number