| CAS Number | 1359828-98-0 |
| Catalog Number | AG009EJR(AGN-PC-0WR0Q5) |
| Chemical Name | Ethyl 2,3-difluoropyridine-4-carboxylate |
| IUPAC Name | ethyl 2,3-difluoropyridine-4-carboxylate |
| InChI | InChI=1S/C8H7F2NO2/c1-2-13-8(12)5-3-4-11-7(10)6(5)9/h3-4H,2H2,1H3 |
| InChI Key | AOJMSQNOPRKCOZ-UHFFFAOYSA-N |
| MDL Number | MFCD21365096 |
| Molecular Formula | C8H7F2NO2 |
| Molecular Weight | 187.1435 |
| SMILES | CCOC(=O)c1ccnc(c1F)F |
| Synonyms | Ethyl 2,3-difluoroisonicotinate,
1359828-98-0,
Ethyl 2,3-difluoropyridine-4-carboxylate,
ZINC95616322,
C-0178,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.146g/mol |
| Monoisotopic Mass | 187.044g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number