| CAS Number | 1807008-13-4 |
| Catalog Number | AG01FGWM(AGN-PC-3H4AL3) |
| Chemical Name | 4-Bromo-2-fluoro-6-iodonitrobenzene |
| IUPAC Name | 5-bromo-1-fluoro-3-iodo-2-nitrobenzene |
| InChI | InChI=1S/C6H2BrFINO2/c7-3-1-4(8)6(10(11)12)5(9)2-3/h1-2H |
| InChI Key | QQFBEHHMRSNUOL-UHFFFAOYSA-N |
| MDL Number | MFCD28348556 |
| Molecular Formula | C6H2BrFINO2 |
| Molecular Weight | 345.8925 |
| SMILES | BrC1=CC(=C(C(=C1)I)[N+](=O)[O-])F |
| Synonyms | 1807008-13-4,
1-Bromo-3-fluoro-5-iodo-4-nitrobenzene,
4-Bromo-2-fluoro-6-iodonitrobenzene,
MFCD28348556,
ZINC169800551,
FCH4124874,
PC501275,
PS-10356,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 344.83g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 345.894g/mol |
| Monoisotopic Mass | 344.83g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number