| CAS Number | 191847-26-4 |
| Catalog Number | AG01DLI5(AGN-PC-0O67BX) |
| Chemical Name | 1-BROMO-2-CHLORO-3,5-DIMETHOXYBENZENE |
| IUPAC Name | 1-bromo-2-chloro-3,5-dimethoxybenzene |
| InChI | InChI=1S/C8H8BrClO2/c1-11-5-3-6(9)8(10)7(4-5)12-2/h3-4H,1-2H3 |
| InChI Key | DDWCSARAFAAXOC-UHFFFAOYSA-N |
| MDL Number | MFCD24153923 |
| Molecular Formula | C8H8Br2O2 |
| Molecular Weight | 295.9559 |
| SMILES | c1c(cc(c(c1Br)Br)OC)OC |
| Synonyms | 1-bromo-2-chloro-3,5-dimethoxybenzene,
191847-26-4,
81574-72-3,
MFCD24153923,
ZINC98210139,
AKOS020298866,
AS-44452,
Z1945708511,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.504g/mol |
| Monoisotopic Mass | 249.94g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number