| CAS Number | 109803-52-3 |
| Catalog Number | AG00HBLN(AGN-PC-00OD30) |
| Chemical Name | 1-Bromo-2,3-dichloro-4-methoxybenzene |
| IUPAC Name | 1-bromo-2,3-dichloro-4-methoxybenzene |
| InChI | InChI=1S/C7H5BrCl2O/c1-11-5-3-2-4(8)6(9)7(5)10/h2-3H,1H3 |
| InChI Key | BTRCDLZQISXWHZ-UHFFFAOYSA-N |
| MDL Number | MFCD21609662 |
| Molecular Formula | C7H5BrCl2O |
| Molecular Weight | 255.9240 |
| SMILES | COc1ccc(c(c1Cl)Cl)Br |
| Synonyms | 1-Bromo-2,3-dichloro-4-methoxybenzene,
2,3-dichloro-4-bromoanisole,
109803-52-3,
bromodichloroanisole,
SCHEMBL6865460,
BTRCDLZQISXWHZ-UHFFFAOYSA-N,
MFCD21609662,
ZINC34183587,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.89g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.92g/mol |
| Monoisotopic Mass | 253.89g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number