| CAS Number | 1242339-82-7 |
| Catalog Number | AG009VWA |
| Chemical Name | 2-Bromo-4-chloro-5-fluorotoluene |
| IUPAC Name | 1-bromo-5-chloro-4-fluoro-2-methylbenzene |
| InChI | InChI=1S/C7H5BrClF/c1-4-2-7(10)6(9)3-5(4)8/h2-3H,1H3 |
| InChI Key | QFIDNOZNUSQTAE-UHFFFAOYSA-N |
| MDL Number | MFCD16817676 |
| Molecular Formula | C7H5BrClF |
| Molecular Weight | 223.4700 |
| SMILES | C1(=CC(=C(C=C1F)C)Br)Cl |
| Synonyms | 2-Bromo-4-chloro-5-fluorotoluene,
1242339-82-7,
1-bromo-5-chloro-4-fluoro-2-methylbenzene,
SCHEMBL10872236,
ZINC67794473,
AKOS024094450,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.469g/mol |
| Monoisotopic Mass | 221.925g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number