| CAS Number | 1803590-57-9 |
| Catalog Number | AG01BDG2(AGN-PC-0WOQND) |
| Chemical Name | 1-(azetidin-3-yl)-4-methylpiperazine trihydrochloride |
| IUPAC Name | 1-(azetidin-3-yl)-4-methylpiperazine;trihydrochloride |
| InChI | InChI=1S/C8H17N3.3ClH/c1-10-2-4-11(5-3-10)8-6-9-7-8;;;/h8-9H,2-7H2,1H3;3*1H |
| InChI Key | FDTBTIGNZRBMBK-UHFFFAOYSA-N |
| MDL Number | MFCD28118247 |
| Molecular Formula | C8H20Cl3N3 |
| Molecular Weight | 264.6235 |
| SMILES | CN1CCN(CC1)C1CNC1.Cl.Cl.Cl |
| Synonyms | 1803590-57-9,
1-(Azetidin-3-yl)-4-methylpiperazine trihydrochloride,
1-(3-Azetidinyl)-4-methylpiperazine 3HCl,
MFCD28118247,
AKOS026741183,
1-(Azetidin-3-yl)-4-methylpiperazine 3HCl,
302355-82-4,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.619g/mol |
| Monoisotopic Mass | 263.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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