| CAS Number | 1805648-67-2 |
| Catalog Number | AG01FSNM(AGN-PC-3H609C) |
| Chemical Name | Ethyl 6-chloro-3-nitropicolinate |
| IUPAC Name | ethyl 6-chloro-3-nitropyridine-2-carboxylate |
| InChI | InChI=1S/C8H7ClN2O4/c1-2-15-8(12)7-5(11(13)14)3-4-6(9)10-7/h3-4H,2H2,1H3 |
| InChI Key | MUYYRHKUFWKCBU-UHFFFAOYSA-N |
| MDL Number | MFCD28757779 |
| Molecular Formula | C8H7ClN2O4 |
| Molecular Weight | 230.6052 |
| SMILES | O=C(OCC)C1=NC(Cl)=CC=C1[N+]([O-])=O |
| Synonyms | Ethyl 6-chloro-3-nitropicolinate,
1805648-67-2,
ZINC396159939,
AX8341637,
AK00743284,
|
| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.009434g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.6g/mol |
| Monoisotopic Mass | 230.009434g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 85Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number