| CAS Number | 916762-48-6 |
| Catalog Number | AG00IGU4(AGN-PC-00X95P) |
| Chemical Name | 1-[4-(Piperidin-1-ylcarbonyl)phenyl]methanamine, HCl |
| IUPAC Name | [4-(aminomethyl)phenyl]-piperidin-1-ylmethanone;hydrochloride |
| InChI | InChI=1S/C13H18N2O.ClH/c14-10-11-4-6-12(7-5-11)13(16)15-8-2-1-3-9-15;/h4-7H,1-3,8-10,14H2;1H |
| InChI Key | RUDJJOSAVRYRNV-UHFFFAOYSA-N |
| MDL Number | MFCD07355818 |
| Molecular Formula | C13H19ClN2O |
| Molecular Weight | 254.7558 |
| SMILES | C(=O)(C1=CC=C(C=C1)CN)N1CCCCC1.Cl |
| Synonyms | 916762-48-6,
1-[4-(piperidin-1-ylcarbonyl)phenyl]methanamine hydrochloride,
[4-(piperidine-1-carbonyl)phenyl]methanamine hydrochloride,
(4-(Aminomethyl)phenyl)(piperidin-1-yl)methanone hydrochloride,
1-[4-(1-PIPERIDINYLCARBONYL)PHENYL]METHANAMINE HYDROCHLORIDE,
MFCD07355818,
AC1Q3D72,
CTK7E4295,
AKOS008058872,
MCULE-8333798172,
NE58393,
EN300-14966,
Methanone, [4-(aminomethyl)phenyl]-1-piperidinyl-, hydrochloride (1:1),
[3-(piperidin-1-ylcarbonyl)phenyl]methanamine,
292635-34-8,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.119g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.758g/mol |
| Monoisotopic Mass | 254.119g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number