| CAS Number | 1447607-42-2 |
| Catalog Number | AG01DLDA |
| Chemical Name | 2-(Piperidin-4-yl)pyrimidine-5-carboxylic acid hydrochloride |
| IUPAC Name | 2-piperidin-4-ylpyrimidine-5-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C10H13N3O2.ClH/c14-10(15)8-5-12-9(13-6-8)7-1-3-11-4-2-7;/h5-7,11H,1-4H2,(H,14,15);1H |
| InChI Key | AKNAFXYFJWVRNI-UHFFFAOYSA-N |
| MDL Number | MFCD25542076 |
| Molecular Formula | C10H14ClN3O2 |
| Molecular Weight | 243.6901 |
| SMILES | Cl.OC(=O)C1=CN=C(N=C1)C1CCNCC1 |
| Synonyms | 1447607-42-2,
2-(PIPERIDIN-4-YL)PYRIMIDINE-5-CARBOXYLIC ACID HCL,
2-(Piperidin-4-yl)pyrimidine-5-carboxylic acid hydrochloride,
MFCD25542076,
AS-41715,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.691g/mol |
| Monoisotopic Mass | 243.077g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 75.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number