| CAS Number | 1891156-20-9 |
| Catalog Number | AG01BJ93 |
| Chemical Name | methyl 1-bromoimidazo[1,5-a]pyridine-6-carboxylate |
| IUPAC Name | methyl 1-bromoimidazo[1,5-a]pyridine-6-carboxylate |
| InChI | InChI=1S/C9H7BrN2O2/c1-14-9(13)6-2-3-7-8(10)11-5-12(7)4-6/h2-5H,1H3 |
| InChI Key | RPVQCJCWRCKXHF-UHFFFAOYSA-N |
| MDL Number | MFCD30752445 |
| Molecular Formula | C9H7BrN2O2 |
| Molecular Weight | 255.0681 |
| SMILES | COC(C1=CN2C(=C(N=C2)Br)C=C1)=O |
| Synonyms | Methyl 1-bromoimidazo[1,5-a]pyridine-6-carboxylate,
ZINC258363381,
1891156-20-9,
N/A,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.969g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.071g/mol |
| Monoisotopic Mass | 253.969g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number