| CAS Number | 1209326-97-5 |
| Catalog Number | AG019X44 |
| Chemical Name | 1-(5-Chloropyridin-2-yl)piperidine-4-carboxylic acid hydrochloride |
| IUPAC Name | 1-(5-chloropyridin-2-yl)piperidine-4-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C11H13ClN2O2.ClH/c12-9-1-2-10(13-7-9)14-5-3-8(4-6-14)11(15)16;/h1-2,7-8H,3-6H2,(H,15,16);1H |
| InChI Key | LZAIRSVXZHDYEN-UHFFFAOYSA-N |
| MDL Number | MFCD13195978 |
| Molecular Formula | C11H14Cl2N2O2 |
| Molecular Weight | 277.1471 |
| SMILES | Cl.OC(C1CCN(C2=NC=C(Cl)C=C2)CC1)=O |
| Synonyms | 1-(5-chloropyridin-2-yl)piperidine-4-carboxylic acid hydrochloride,
1209326-97-5,
AC1Q3EZ5,
SCHEMBL895936,
CTK7J0055,
LZAIRSVXZHDYEN-UHFFFAOYSA-N,
NE35092,
EN300-53997,
5'-chloro-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-carboxylic acid hydrochloride,
|
| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.145g/mol |
| Monoisotopic Mass | 276.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number