| CAS Number | 126826-29-7 |
| Catalog Number | AG00A0HS |
| Chemical Name | 6-Bromo-3-chloro-2-methylaniline |
| IUPAC Name | 6-bromo-3-chloro-2-methylaniline |
| InChI | InChI=1S/C7H7BrClN/c1-4-6(9)3-2-5(8)7(4)10/h2-3H,10H2,1H3 |
| InChI Key | IWFNVSLNDDOXOZ-UHFFFAOYSA-N |
| MDL Number | MFCD30183555 |
| Molecular Formula | C7H7BrClN |
| Molecular Weight | 220.4942 |
| SMILES | NC1C(Br)=CC=C(Cl)C=1C |
| Synonyms | 6-bromo-3-chloro-2-methylaniline,
126826-29-7,
SCHEMBL8956522,
AKOS027427257,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.494g/mol |
| Monoisotopic Mass | 218.945g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number