| CAS Number | 24786-54-7 |
| Catalog Number | AG01EL5I |
| Chemical Name | 6-Bromo-1-methyl-1H-1,3-benzodiazol-2-amine |
| IUPAC Name | 6-bromo-1-methylbenzimidazol-2-amine |
| InChI | InChI=1S/C8H8BrN3/c1-12-7-4-5(9)2-3-6(7)11-8(12)10/h2-4H,1H3,(H2,10,11) |
| InChI Key | OEHIYNMMAZCNCE-UHFFFAOYSA-N |
| MDL Number | MFCD21194033 |
| Molecular Formula | C8H8BrN3 |
| Molecular Weight | 226.0732 |
| SMILES | Cn1c2cc(ccc2nc1N)Br |
| Synonyms | SCHEMBL14247671,
AKOS014682368,
24786-54-7,
6-bromo-1-methyl-1H-1,3-benzodiazol-2-amine,
6-Bromo-1-methyl-1H-benzo[d]imidazol-2-amine,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.077g/mol |
| Monoisotopic Mass | 224.99g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number