| CAS Number | 1240528-76-0 |
| Catalog Number | AG01A9BU(AGN-PC-0WOT3L) |
| Chemical Name | 4-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidine hydrochloride |
| IUPAC Name | 4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)piperidine;hydrochloride |
| InChI | InChI=1S/C10H16N4.ClH/c1-2-7(1)9-12-10(14-13-9)8-3-5-11-6-4-8;/h7-8,11H,1-6H2,(H,12,13,14);1H |
| InChI Key | HYHBYSLPMRQLTO-UHFFFAOYSA-N |
| MDL Number | MFCD16547713 |
| Molecular Formula | C10H17ClN4 |
| Molecular Weight | 228.7218 |
| SMILES | Cl.C1C(C2NN=C(C3CCNCC3)N=2)C1 |
| Synonyms | 4-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)piperidine hydrochloride,
1240528-76-0,
AC1Q38TL,
AKOS025440147,
MCULE-6008617383,
NE61588,
EN300-64664,
Z1262327484,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.724g/mol |
| Monoisotopic Mass | 228.114g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number