| CAS Number | 1208077-17-1 |
| Catalog Number | AG00HFRQ(AGN-PC-0WALGH) |
| Chemical Name | 2-Bromo-4-chloro-m-xylene |
| IUPAC Name | 3-bromo-1-chloro-2,4-dimethylbenzene |
| InChI | InChI=1S/C8H8BrCl/c1-5-3-4-7(10)6(2)8(5)9/h3-4H,1-2H3 |
| InChI Key | SYJGOCCALRWSID-UHFFFAOYSA-N |
| MDL Number | MFCD12922559 |
| Molecular Formula | C8H8BrCl |
| Molecular Weight | 219.5061 |
| SMILES | BrC1=C(C=CC(=C1C)Cl)C |
| Synonyms | 2-Bromo-4-chloro-m-xylene,
1208077-17-1,
2-Bromo-4-chloro-1,3-dimethylbenzene,
ZINC66318856,
FS-6450,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.94979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.5g/mol |
| Monoisotopic Mass | 217.94979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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Certificate of Analysis
Lot Number