| CAS Number | 1293385-31-5 |
| Catalog Number | AG01DLCL |
| Chemical Name | 2-CHLORO-6-MORPHOLINONICOTINIC ACID |
| IUPAC Name | 2-chloro-6-morpholin-4-ylpyridine-3-carboxylic acid |
| InChI | InChI=1S/C10H11ClN2O3/c11-9-7(10(14)15)1-2-8(12-9)13-3-5-16-6-4-13/h1-2H,3-6H2,(H,14,15) |
| InChI Key | UYTBVDIXOZASRT-UHFFFAOYSA-N |
| MDL Number | MFCD19382448 |
| Molecular Formula | C10H11ClN2O3 |
| Molecular Weight | 242.6589 |
| SMILES | OC(=O)C1=CC=C(N=C1Cl)N1CCOCC1 |
| Synonyms | 2-CHLORO-6-MORPHOLINONICOTINIC ACID,
1293385-31-5,
MFCD19382448,
ZINC66055023,
AS-36107,
|
| Complexity | 258 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.659g/mol |
| Monoisotopic Mass | 242.046g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 62.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number