| CAS Number | 1376041-68-7 |
| Catalog Number | AG019U4U(AGN-PC-0WOR9Z) |
| Chemical Name | 4-aminopiperidine-4-carbonitrile dihydrochloride |
| IUPAC Name | 4-aminopiperidine-4-carbonitrile;dihydrochloride |
| InChI | InChI=1S/C6H11N3.2ClH/c7-5-6(8)1-3-9-4-2-6;;/h9H,1-4,8H2;2*1H |
| InChI Key | LYDLQSDFPXZTNR-UHFFFAOYSA-N |
| MDL Number | MFCD22056349 |
| Molecular Formula | C6H13Cl2N3 |
| Molecular Weight | 198.0935 |
| SMILES | Cl.Cl.NC1(C#N)CCNCC1 |
| Synonyms | 4-aminopiperidine-4-carbonitrile dihydrochloride,
1376041-68-7,
AKOS016908554,
MCULE-2533087462,
NE61840,
EN300-100403,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.091g/mol |
| Monoisotopic Mass | 197.049g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 61.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number