| CAS Number | 1226070-17-2 |
| Catalog Number | AG01ALDT |
| Chemical Name | 5-bromo-7-chloro-2-methyl-1,3-benzoxazole |
| IUPAC Name | 5-bromo-7-chloro-2-methyl-1,3-benzoxazole |
| InChI | InChI=1S/C8H5BrClNO/c1-4-11-7-3-5(9)2-6(10)8(7)12-4/h2-3H,1H3 |
| InChI Key | VCZVBVOJGPFUNJ-UHFFFAOYSA-N |
| MDL Number | MFCD16468637 |
| Molecular Formula | C8H5BrClNO |
| Molecular Weight | 246.4884 |
| SMILES | CC1=NC2=CC(=CC(=C2O1)Cl)Br |
| Synonyms | 1226070-17-2,
5-bromo-7-chloro-2-methyl-1,3-benzoxazole,
5-Bromo-7-chloro-2-methylbenzo[d]oxazole,
SCHEMBL14758466,
ZINC41569052,
AKOS022324712,
Z2188171741,
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.924g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.488g/mol |
| Monoisotopic Mass | 244.924g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number