| CAS Number | 57645-53-1 |
| Catalog Number | AG01B53V |
| Chemical Name | 1-[(3-METHOXYPHENYL)METHYL]PIPERIDIN-4-AMINE DIHYDROCHLORIDE |
| IUPAC Name | 1-[(3-methoxyphenyl)methyl]piperidin-4-amine;dihydrochloride |
| InChI | InChI=1S/C13H20N2O.2ClH/c1-16-13-4-2-3-11(9-13)10-15-7-5-12(14)6-8-15;;/h2-4,9,12H,5-8,10,14H2,1H3;2*1H |
| InChI Key | RXZBRMGOZIVRMO-UHFFFAOYSA-N |
| MDL Number | MFCD15200716 |
| Molecular Formula | C13H22Cl2N2O |
| Molecular Weight | 293.2326 |
| SMILES | COC1=CC=CC(=C1)CN2CCC(CC2)N.Cl.Cl |
| Synonyms | 1-(3-Methoxybenzyl)piperidin-4-amine dihydrochloride,
57645-53-1,
1-[(3-methoxyphenyl)methyl]piperidin-4-amine dihydrochloride,
SCHEMBL11535920,
AKOS027385871,
KS-6066,
Z2512942885,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.232g/mol |
| Monoisotopic Mass | 292.111g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number