| CAS Number | 91419-61-3 |
| Catalog Number | AG01A21S(AGN-PC-0VSBJB) |
| Chemical Name | 3-(1H-1,2,3,4-Tetrazol-5-yl)piperidine hydrochloride |
| IUPAC Name | 3-(2H-tetrazol-5-yl)piperidine;hydrochloride |
| InChI | InChI=1S/C6H11N5.ClH/c1-2-5(4-7-3-1)6-8-10-11-9-6;/h5,7H,1-4H2,(H,8,9,10,11);1H |
| InChI Key | KSOUXMGCAWTMTN-UHFFFAOYSA-N |
| MDL Number | MFCD22566018 |
| Molecular Formula | C6H12ClN5 |
| Molecular Weight | 189.6460 |
| SMILES | [H]Cl.C1(C2=NN=NN2)CNCCC1 |
| Synonyms | 3-(1H-1,2,3,4-tetrazol-5-yl)piperidine hydrochloride,
91419-61-3,
AKOS026741411,
NE37600,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.647g/mol |
| Monoisotopic Mass | 189.078g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number