| CAS Number | 1160573-77-2 |
| Catalog Number | AG01FEJR(AGN-PC-3H4A29) |
| Chemical Name | 1,5-Dibromo-2-chloro-3-ethylbenzene |
| IUPAC Name | 1,5-dibromo-2-chloro-3-ethylbenzene |
| InChI | InChI=1S/C8H7Br2Cl/c1-2-5-3-6(9)4-7(10)8(5)11/h3-4H,2H2,1H3 |
| InChI Key | QTASKJLZXKVSCK-UHFFFAOYSA-N |
| MDL Number | MFCD11846038 |
| Molecular Formula | C8H7Br2Cl |
| Molecular Weight | 298.4022 |
| SMILES | CCc1cc(Br)cc(c1Cl)Br |
| Synonyms | 2-Chloro-3,5-dibromoethylbenzene,
1160573-77-2,
1,5-dibromo-2-chloro-3-ethylbenzene,
ZINC65356444,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.858g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.402g/mol |
| Monoisotopic Mass | 295.86g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
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Certificate of Analysis
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