| CAS Number | 1000578-24-4 |
| Catalog Number | AG01EQJZ(AGN-PC-3H47BC) |
| Chemical Name | 1,5-Dibromo-2-chloro-3-(trifluoromethoxy)benzene |
| IUPAC Name | 1,5-dibromo-2-chloro-3-(trifluoromethoxy)benzene |
| InChI | InChI=1S/C7H2Br2ClF3O/c8-3-1-4(9)6(10)5(2-3)14-7(11,12)13/h1-2H |
| InChI Key | IPQDWNHRSFLBRN-UHFFFAOYSA-N |
| MDL Number | MFCD09878142 |
| Molecular Formula | C7H2Br2ClF3O |
| Molecular Weight | 354.3464 |
| SMILES | C(F)(F)(F)OC1=C(Cl)C(Br)=CC(Br)=C1 |
| Synonyms | 3,5-Dibromo-2-chlorotrifluoromethoxybenzene,
1000578-24-4,
1,5-dibromo-2-chloro-3-(trifluoromethoxy)benzene,
DTXSID80650244,
ZINC15444505,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 353.809g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 354.345g/mol |
| Monoisotopic Mass | 351.811g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number