| CAS Number | 1394003-92-9 |
| Catalog Number | AG01EL8Z |
| Chemical Name | Methyl 8-chloro-1,7-naphthyridine-3-carboxylate |
| IUPAC Name | methyl 8-chloro-1,7-naphthyridine-3-carboxylate |
| InChI | InChI=1S/C10H7ClN2O2/c1-15-10(14)7-4-6-2-3-12-9(11)8(6)13-5-7/h2-5H,1H3 |
| InChI Key | MPUZYBRGVLKUNP-UHFFFAOYSA-N |
| MDL Number | MFCD22543801 |
| Molecular Formula | C10H7ClN2O2 |
| Molecular Weight | 222.6278 |
| SMILES | O=C(C1=CC2=C(C(Cl)=NC=C2)N=C1)OC |
| Synonyms | methyl 8-chloro-1,7-naphthyridine-3-carboxylate,
1394003-92-9,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.628g/mol |
| Monoisotopic Mass | 222.02g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number