| CAS Number | 1208076-06-5 |
| Catalog Number | AG01DNNO |
| Chemical Name | 2-Bromo-1,3-difluoro-4-iodobenzene |
| IUPAC Name | 2-bromo-1,3-difluoro-4-iodobenzene |
| InChI | InChI=1S/C6H2BrF2I/c7-5-3(8)1-2-4(10)6(5)9/h1-2H |
| InChI Key | TUWGVTORNOVLIJ-UHFFFAOYSA-N |
| MDL Number | MFCD12922603 |
| Molecular Formula | C6H2BrF2I |
| Molecular Weight | 318.8854 |
| SMILES | C1=CC(=C(C(=C1F)Br)F)I |
| Synonyms | 2-Bromo-1,3-difluoro-4-iodobenzene,
1208076-06-5,
SCHEMBL8979083,
DTXSID50596882,
TUWGVTORNOVLIJ-UHFFFAOYSA-N,
MFCD12922603,
ZINC66318926,
AKOS024264345,
Y3813,
Q-8624,
C6H2BrF2I,
|
| 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