| CAS Number | 2060035-98-3 |
| Catalog Number | AG01C001 |
| Chemical Name | Methyl 8-bromo-1,6-naphthyridine-2-carboxylate hydrobromide |
| IUPAC Name | methyl 8-bromo-1,6-naphthyridine-2-carboxylate;hydrobromide |
| InChI | InChI=1S/C10H7BrN2O2.BrH/c1-15-10(14)8-3-2-6-4-12-5-7(11)9(6)13-8;/h2-5H,1H3;1H |
| InChI Key | FBIJKAUIDBJENR-UHFFFAOYSA-N |
| MDL Number | MFCD30497745 |
| Molecular Formula | C10H8Br2N2O2 |
| Molecular Weight | 347.9907 |
| SMILES | Br.COC(C1=NC2=C(C=NC=C2Br)C=C1)=O |
| Synonyms | methyl 8-bromo-1,6-naphthyridine-2-carboxylate hydrobromide,
2060035-98-3,
Z2692095215,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 347.893g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 347.994g/mol |
| Monoisotopic Mass | 345.895g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number