| CAS Number | 2059941-68-1 |
| Catalog Number | AG01C00S |
| Chemical Name | 1-[(1,3-Thiazol-5-yl)methyl]piperazine trihydrochloride |
| IUPAC Name | 5-(piperazin-1-ylmethyl)-1,3-thiazole;trihydrochloride |
| InChI | InChI=1S/C8H13N3S.3ClH/c1-3-11(4-2-9-1)6-8-5-10-7-12-8;;;/h5,7,9H,1-4,6H2;3*1H |
| InChI Key | YKAWCCRMCLBNRY-UHFFFAOYSA-N |
| MDL Number | MFCD30497760 |
| Molecular Formula | C8H16Cl3N3S |
| Molecular Weight | 292.6567 |
| SMILES | Cl.Cl.Cl.C(C1SC=NC=1)N1CCNCC1 |
| Synonyms | 1-[(1,3-thiazol-5-yl)methyl]piperazine trihydrochloride,
2059941-68-1,
Z2719321984,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 291.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 292.647g/mol |
| Monoisotopic Mass | 291.013g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number