| CAS Number | 1390654-38-2 |
| Catalog Number | AG00AAYA(AGN-PC-0WRAMM) |
| Chemical Name | 1-methyl-4-(3-pyrrolidinyl)piperazine trihydrochloride |
| IUPAC Name | 1-methyl-4-pyrrolidin-3-ylpiperazine;trihydrochloride |
| InChI | InChI=1S/C9H19N3.3ClH/c1-11-4-6-12(7-5-11)9-2-3-10-8-9;;;/h9-10H,2-8H2,1H3;3*1H |
| InChI Key | IVMWYPBOTNWLLF-UHFFFAOYSA-N |
| MDL Number | MFCD19103333 |
| Molecular Formula | C9H22Cl3N3 |
| Molecular Weight | 278.6501 |
| SMILES | N1(C2CNCC2)CCN(CC1)C.Cl.Cl.Cl |
| Synonyms | 1390654-38-2,
1-Methyl-4-(3-pyrrolidinyl)piperazine trihydrochloride,
1-Methyl-4-(3-pyrrolidinyl)-piperazine trihydrochloride,
1-Methyl-4-(3-pyrrolidinyl)-piperazine 3HCl,
ZX-CM005047,
MFCD19103333,
1-Methyl-4-(3-pyrrolidinyl)piperazine 3HCl,
1-Methyl-4-(3-pyrrolidinyl)piperazine trihydrochloride, AldrichCPR,
202991-92-2,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.646g/mol |
| Monoisotopic Mass | 277.088g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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