| CAS Number | 1349716-82-0 |
| Catalog Number | AG01FENT(AGN-PC-3H4A2L) |
| Chemical Name | 4-Bromo-2,3-difluorobenzenethiol |
| IUPAC Name | 4-bromo-2,3-difluorobenzenethiol |
| InChI | InChI=1S/C6H3BrF2S/c7-3-1-2-4(10)6(9)5(3)8/h1-2,10H |
| InChI Key | PAZWEKHMOVSKCC-UHFFFAOYSA-N |
| MDL Number | MFCD20233345 |
| Molecular Formula | C6H3BrF2S |
| Molecular Weight | 225.0538 |
| SMILES | Sc1ccc(c(c1F)F)Br |
| Synonyms | 4-Bromo-2,3-difluorobenzenethiol,
1349716-82-0,
ZINC71792185,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.911g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.051g/mol |
| Monoisotopic Mass | 223.911g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
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Lot Number