| CAS Number | 57645-60-0 |
| Catalog Number | AG00J1NF(AGN-PC-0WB6QH) |
| Chemical Name | 1-(2-Chlorobenzyl)-4-piperidinamine dihydrochloride |
| IUPAC Name | 1-[(2-chlorophenyl)methyl]piperidin-4-amine;dihydrochloride |
| InChI | InChI=1S/C12H17ClN2.2ClH/c13-12-4-2-1-3-10(12)9-15-7-5-11(14)6-8-15;;/h1-4,11H,5-9,14H2;2*1H |
| InChI Key | POWGOBAIJJFGPL-UHFFFAOYSA-N |
| MDL Number | MFCD11841315 |
| Molecular Formula | C12H19Cl3N2 |
| Molecular Weight | 297.6517 |
| SMILES | N1(CCC(CC1)N)CC1=CC=CC=C1Cl.Cl.Cl |
| Synonyms | 57645-60-0,
1-(2-Chlorobenzyl)piperidin-4-amine dihydrochloride,
1-(2-chlorobenzyl)-4-piperidinamine dihydrochloride,
SCHEMBL11533303,
ZX-CM005277,
MFCD11841315,
AKOS027386016,
KS-6187,
4023482-25G,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 296.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 297.648g/mol |
| Monoisotopic Mass | 296.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number