| CAS Number | 1171985-70-8 |
| Catalog Number | AG008SLP |
| Chemical Name | 3-(4-Phenoxy-benzyl)-piperidine hydrochloride |
| IUPAC Name | 3-[(4-phenoxyphenyl)methyl]piperidine;hydrochloride |
| InChI | InChI=1S/C18H21NO.ClH/c1-2-6-17(7-3-1)20-18-10-8-15(9-11-18)13-16-5-4-12-19-14-16;/h1-3,6-11,16,19H,4-5,12-14H2;1H |
| InChI Key | NRANRLYYNKOWGI-UHFFFAOYSA-N |
| MDL Number | MFCD08669689 |
| Molecular Formula | C18H22ClNO |
| Molecular Weight | 303.8264 |
| SMILES | C1CCC(CN1)Cc1ccc(cc1)Oc1ccccc1.Cl |
| Synonyms | 3-(4-Phenoxy-benzyl)-piperidine hydrochloride,
1171985-70-8,
DTXSID10588829,
BP064,
MFCD08669689,
AB45985,
OR307737,
3-(4-Phenoxybenzyl)piperidine hydrochloride,
T6215,
3-[(4-Phenoxyphenyl)methyl]piperidine--hydrogen chloride (1/1),
|
| Complexity | 267 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 303.139g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 303.83g/mol |
| Monoisotopic Mass | 303.139g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number