| CAS Number | 1354962-18-7 |
| Catalog Number | AG019S82 |
| Chemical Name | methyl 1-[(3-methoxyphenyl)methyl]piperidine-4-carboxylate |
| IUPAC Name | methyl 1-[(3-methoxyphenyl)methyl]piperidine-4-carboxylate |
| InChI | InChI=1S/C15H21NO3/c1-18-14-5-3-4-12(10-14)11-16-8-6-13(7-9-16)15(17)19-2/h3-5,10,13H,6-9,11H2,1-2H3 |
| InChI Key | BYQWKLJBCWJJBY-UHFFFAOYSA-N |
| MDL Number | MFCD15481044 |
| Molecular Formula | C15H21NO3 |
| Molecular Weight | 263.3321 |
| SMILES | COC(C1CCN(CC2=CC(OC)=CC=C2)CC1)=O |
| Synonyms | methyl 1-[(3-methoxyphenyl)methyl]piperidine-4-carboxylate,
1354962-18-7,
ZINC47916521,
AKOS008953333,
MCULE-3369317485,
NE26612,
EN300-92146,
Z54999091,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.337g/mol |
| Monoisotopic Mass | 263.152g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number