| CAS Number | 1349718-22-4 |
| Catalog Number | AG01ESD9(AGN-PC-3H47F7) |
| Chemical Name | 1-Bromo-4,5-difluoro-2-iodobenzene |
| IUPAC Name | 1-bromo-4,5-difluoro-2-iodobenzene |
| InChI | InChI=1S/C6H2BrF2I/c7-3-1-4(8)5(9)2-6(3)10/h1-2H |
| InChI Key | ZAKBIMNEMILSPG-UHFFFAOYSA-N |
| MDL Number | MFCD20233325 |
| Molecular Formula | C6H2BrF2I |
| Molecular Weight | 318.8854 |
| SMILES | Brc1c(I)cc(c(c1)F)F |
| Synonyms | 1-bromo-4,5-difluoro-2-iodobenzene,
1349718-22-4,
2-Bromo-4,5-difluoroiodobenzene,
MFCD20233325,
ZINC71792154,
AKOS027279953,
FS-6133,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 317.835g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 318.887g/mol |
| Monoisotopic Mass | 317.835g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number