| CAS Number | 141109-44-6 |
| Catalog Number | AG01ACKL(AGN-PC-0PQB53) |
| Chemical Name | ethyl 2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetate |
| IUPAC Name | ethyl 2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetate |
| InChI | InChI=1S/C11H19NO3/c1-4-15-11(14)10(13)12-8(2)6-5-7-9(12)3/h8-9H,4-7H2,1-3H3 |
| InChI Key | YXPMAWBCWXIFOT-UHFFFAOYSA-N |
| MDL Number | MFCD12803715 |
| Molecular Formula | C11H19NO3 |
| Molecular Weight | 213.2735 |
| SMILES | CCOC(C(N1C(C)CCCC1C)=O)=O |
| Synonyms | ethyl 2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetate,
141109-44-6,
SCHEMBL8958031,
NE50387,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.277g/mol |
| Monoisotopic Mass | 213.136g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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