| CAS Number | 908095-31-8 |
| Catalog Number | AG01DWTT |
| Chemical Name | Methyl 1-cyclopropyl-4-oxopiperidine-3-carboxylate |
| IUPAC Name | methyl 1-cyclopropyl-4-oxopiperidine-3-carboxylate |
| InChI | InChI=1S/C10H15NO3/c1-14-10(13)8-6-11(7-2-3-7)5-4-9(8)12/h7-8H,2-6H2,1H3 |
| InChI Key | IQUYUIVHPZAXHF-UHFFFAOYSA-N |
| MDL Number | MFCD16304441 |
| Molecular Formula | C10H15NO3 |
| Molecular Weight | 197.231 |
| SMILES | COC(C1C(=O)CCN(C2CC2)C1)=O |
| Synonyms | methyl 1-cyclopropyl-4-oxopiperidine-3-carboxylate,
908095-31-8,
SCHEMBL858717,
methyl 1-cyclopropyl-4-oxo-3-piperidinecarboxylate,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.234g/mol |
| Monoisotopic Mass | 197.105g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
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