| CAS Number | 1208075-99-3 |
| Catalog Number | AG01BFN6 |
| Chemical Name | 1-Bromo-2,4-Difluoro-3-Iodobenzene |
| IUPAC Name | 1-bromo-2,4-difluoro-3-iodobenzene |
| InChI | InChI=1S/C6H2BrF2I/c7-3-1-2-4(8)6(10)5(3)9/h1-2H |
| InChI Key | AQPVCNLHVZIFBI-UHFFFAOYSA-N |
| MDL Number | MFCD12922602 |
| Molecular Formula | C6H2BrF2I |
| Molecular Weight | 318.8854 |
| SMILES | IC1=C(F)C(Br)=CC=C1F |
| Synonyms | 1-bromo-2,4-difluoro-3-iodobenzene,
1208075-99-3,
3-Bromo-2,6-difluoroiodobenzene,
SCHEMBL16618074,
ZINC66318923,
AKOS027305015,
NE18081,
Z1895553933,
|
| 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