| CAS Number | 462114-38-1 |
| Catalog Number | AG01FM0Z(AGN-PC-3H5M60) |
| Chemical Name | 5-Chloro-2-(pyrrolidin-3-yloxy)pyridine |
| IUPAC Name | 5-chloro-2-[(3S)-pyrrolidin-3-yl]oxypyridine |
| InChI | InChI=1S/C9H11ClN2O/c10-7-1-2-9(12-5-7)13-8-3-4-11-6-8/h1-2,5,8,11H,3-4,6H2/t8-/m0/s1 |
| InChI Key | XIAKIURVSAVKQS-QMMMGPOBSA-N |
| MDL Number | MFCD16713981 |
| Molecular Formula | C9H11ClN2O |
| Molecular Weight | 198.6494 |
| SMILES | ClC1C=NC(=CC=1)OC2CNCC2 |
| Synonyms | 5-chloro-2-(pyrrolidin-3-yloxy)pyridine,
MFCD16713981,
ZINC51868424,
462114-38-1,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.65g/mol |
| Monoisotopic Mass | 198.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number