| CAS Number | 915924-93-5 |
| Catalog Number | AG00GTQD(AGN-PC-0WB3MB) |
| Chemical Name | 6-Oxo-1-propylpiperidine-3-carboxylic acid |
| IUPAC Name | 6-oxo-1-propylpiperidine-3-carboxylic acid |
| InChI | InChI=1S/C9H15NO3/c1-2-5-10-6-7(9(12)13)3-4-8(10)11/h7H,2-6H2,1H3,(H,12,13) |
| InChI Key | CJXIDYRIXNBPBI-UHFFFAOYSA-N |
| MDL Number | MFCD08691592 |
| Molecular Formula | C9H15NO3 |
| Molecular Weight | 185.2203 |
| SMILES | N1(CCC)CC(CCC1=O)C(O)=O |
| Synonyms | 915924-93-5,
6-OXO-1-PROPYLPIPERIDINE-3-CARBOXYLIC ACID,
CHEMBRDG-BB 4015795,
CTK5H0168,
DTXSID20660746,
MFCD08691592,
AKOS011497848,
6-Oxo-1-propyl-3-piperidinecarboxylic acid,
Y-4263,
CHEMBRDG-BB4015795,
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| Complexity | 215 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.223g/mol |
| Monoisotopic Mass | 185.105g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 57.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number