| CAS Number | 1000571-63-0 |
| Catalog Number | AG01FFC9(AGN-PC-3H4A54) |
| Chemical Name | 1-Bromo-2,5-dichloro-3-methylbenzene |
| IUPAC Name | 1-bromo-2,5-dichloro-3-methylbenzene |
| InChI | InChI=1S/C7H5BrCl2/c1-4-2-5(9)3-6(8)7(4)10/h2-3H,1H3 |
| InChI Key | NMMXKMKQXFTETN-UHFFFAOYSA-N |
| MDL Number | MFCD09800834 |
| Molecular Formula | C7H5BrCl2 |
| Molecular Weight | 239.9246 |
| SMILES | c1c(cc(c(c1Br)Cl)C)Cl |
| Synonyms | 3-Bromo-2,5-dichlorotoluene,
1000571-63-0,
SCHEMBL13550042,
DTXSID90661528,
ZINC63339604,
1-bromo-2,5-dichloro-3-methylbenzene,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.895g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.921g/mol |
| Monoisotopic Mass | 237.895g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number