| CAS Number | 1823865-12-8 |
| Catalog Number | AG01FHFL(AGN-PC-0WCMIF) |
| Chemical Name | Methyl 3-nitroimidazo[1,2-a]pyridine-7-carboxylate |
| IUPAC Name | methyl 3-nitroimidazo[1,2-a]pyridine-7-carboxylate |
| InChI | InChI=1S/C9H7N3O4/c1-16-9(13)6-2-3-11-7(4-6)10-5-8(11)12(14)15/h2-5H,1H3 |
| InChI Key | FSKZMOLLOXQTRE-UHFFFAOYSA-N |
| MDL Number | MFCD27995618 |
| Molecular Formula | C9H7N3O4 |
| Molecular Weight | 221.1696 |
| SMILES | [N+](=O)([O-])C1=CN=C2N1C=CC(=C2)C(=O)OC |
| Synonyms | methyl 3-nitroimidazo[1,2-a]pyridine-7-carboxylate,
1823865-12-8,
KS-00003H6Q,
MFCD27995618,
ZINC97463344,
AKOS030234233,
AS-8030,
OR110896,
|
| Complexity | 304 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.172g/mol |
| Monoisotopic Mass | 221.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 89.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number