| CAS Number | 1366180-13-3 |
| Catalog Number | AG01C4BC |
| Chemical Name | 3-(piperidin-4-yl)propanenitrile hydrochloride |
| IUPAC Name | 3-piperidin-4-ylpropanenitrile;hydrochloride |
| InChI | InChI=1S/C8H14N2.ClH/c9-5-1-2-8-3-6-10-7-4-8;/h8,10H,1-4,6-7H2;1H |
| InChI Key | UZBQPVXRVPLFBC-UHFFFAOYSA-N |
| MDL Number | MFCD29763082 |
| Molecular Formula | C8H15ClN2 |
| Molecular Weight | 174.6711 |
| SMILES | Cl.N#CCCC1CCNCC1 |
| Synonyms | 3-(piperidin-4-yl)propanenitrile hydrochloride,
1366180-13-3,
F2167-8346,
Z2379802701,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.672g/mol |
| Monoisotopic Mass | 174.092g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number