| CAS Number | 1000574-69-5 |
| Catalog Number | AG01FES5(AGN-PC-3H4A35) |
| Chemical Name | 2,6-Dibromo-3,4-difluoroaniline |
| IUPAC Name | 2,6-dibromo-3,4-difluoroaniline |
| InChI | InChI=1S/C6H3Br2F2N/c7-2-1-3(9)5(10)4(8)6(2)11/h1H,11H2 |
| InChI Key | HWBMIUQUYPJTFK-UHFFFAOYSA-N |
| MDL Number | MFCD09878204 |
| Molecular Formula | C6H3Br2F2N |
| Molecular Weight | 286.8995 |
| SMILES | c1(c(cc(c(c1Br)N)Br)F)F |
| Synonyms | 2,6-Dibromo-3,4-difluoroaniline,
1000574-69-5,
SCHEMBL19475196,
ZINC15444583,
FS-4813,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 286.858g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.902g/mol |
| Monoisotopic Mass | 284.86g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number