| CAS Number | 1354953-43-7 |
| Catalog Number | AG019PSZ(AGN-PC-0WORUO) |
| Chemical Name | 2-[4-(Aminomethyl)piperidin-1-yl]acetonitrile dihydrochloride |
| IUPAC Name | 2-[4-(aminomethyl)piperidin-1-yl]acetonitrile;dihydrochloride |
| InChI | InChI=1S/C8H15N3.2ClH/c9-3-6-11-4-1-8(7-10)2-5-11;;/h8H,1-2,4-7,10H2;2*1H |
| InChI Key | LQVWBOVZEOLNIM-UHFFFAOYSA-N |
| MDL Number | MFCD20441556 |
| Molecular Formula | C8H17Cl2N3 |
| Molecular Weight | 226.1467 |
| SMILES | N#CCN1CCC(CN)CC1.[H]Cl.[H]Cl |
| Synonyms | 2-[4-(aminomethyl)piperidin-1-yl]acetonitrile dihydrochloride,
1354953-43-7,
EN300-86401,
AKOS026742029,
MCULE-4717518290,
NE43921,
Z1259162062,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.145g/mol |
| Monoisotopic Mass | 225.08g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number