| CAS Number | 126291-66-5 |
| Catalog Number | AG00A1U6(AGN-PC-0LO1EJ) |
| Chemical Name | 1-Acetyl-piperidine-4-carboxylic acid methyl ester |
| IUPAC Name | methyl 1-acetylpiperidine-4-carboxylate |
| InChI | InChI=1S/C9H15NO3/c1-7(11)10-5-3-8(4-6-10)9(12)13-2/h8H,3-6H2,1-2H3 |
| InChI Key | XCGYEEUWADWLCT-UHFFFAOYSA-N |
| MDL Number | MFCD02862113 |
| Molecular Formula | C9H15NO3 |
| Molecular Weight | 185.2203 |
| SMILES | C(C)(=O)N1CCC(CC1)C(=O)OC |
| Synonyms | Methyl 1-acetylpiperidine-4-carboxylate,
126291-66-5,
1-Acetyl-piperidine-4-carboxylic acid methyl ester,
AC1NPOCQ,
SCHEMBL3861785,
DTXSID60409237,
XCGYEEUWADWLCT-UHFFFAOYSA-N,
ZINC5495314,
MFCD02862113,
AKOS003593166,
AM91473,
DA-13260,
FT-0730821,
4-Piperidinecarboxylic acid, 1-acetyl-, methyl ester,
CID5182383,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.223g/mol |
| Monoisotopic Mass | 185.105g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number