| CAS Number | 1803562-26-6 |
| Catalog Number | AG01BGO8 |
| Chemical Name | 3-Bromo-2,4-dichloro-1,5-dimethoxybenzene |
| IUPAC Name | 3-bromo-2,4-dichloro-1,5-dimethoxybenzene |
| InChI | InChI=1S/C8H7BrCl2O2/c1-12-4-3-5(13-2)8(11)6(9)7(4)10/h3H,1-2H3 |
| InChI Key | JWWIYVNGLBZQDG-UHFFFAOYSA-N |
| MDL Number | MFCD28125203 |
| Molecular Formula | C8H7BrCl2O2 |
| Molecular Weight | 285.9500 |
| SMILES | COC1=C(Cl)C(Br)=C(Cl)C(OC)=C1 |
| Synonyms | 3-bromo-2,4-dichloro-1,5-dimethoxybenzene,
1803562-26-6,
SCHEMBL16994765,
ZINC98210187,
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| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.901g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 285.946g/mol |
| Monoisotopic Mass | 283.901g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
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Certificate of Analysis
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