| CAS Number | 2095410-90-3 |
| Catalog Number | AG01E8WF |
| Chemical Name | 3-(1H-pyrazol-4-yl)piperidine dihydrochloride |
| IUPAC Name | 3-(1H-pyrazol-4-yl)piperidine;dihydrochloride |
| InChI | InChI=1S/C8H13N3.2ClH/c1-2-7(4-9-3-1)8-5-10-11-6-8;;/h5-7,9H,1-4H2,(H,10,11);2*1H |
| InChI Key | UUCIQSIENLWQIV-UHFFFAOYSA-N |
| MDL Number | MFCD30539880 |
| Molecular Formula | C8H15Cl2N3 |
| Molecular Weight | 224.1308 |
| SMILES | C1(C2CNCCC2)=CNN=C1.Cl.Cl |
| Synonyms | 3-(1H-pyrazol-4-yl)piperidine dihydrochloride,
AKOS032464481,
F9995-3708,
2095410-90-3,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.064303g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.13g/mol |
| Monoisotopic Mass | 223.064303g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.7Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number