Ethyl 1-piperidinecarboxylate is a synthesis reagent used in the electosynthesis of N-acyliminium ion equivalents, identification of tetrahedral hemiacetal alkoxide intermediates and preparation of symmetrical ketones from organolithiums.
A synthesis reagent
| Pubchem Sid | 504753033 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504753033 |
| Canonical Smiles | CCOC(=O)N1CCCCC1 |
| IUPAC Name | ethyl piperidine-1-carboxylate |
| InChIKey | YSPVHAUJXLGZHP-UHFFFAOYSA-N |
| INCHI | 1S/C8H15NO2/c1-2-11-8(10)9-6-4-3-5-7-9/h2-7H2,1H3 |
| Isomeric SMILES | CCOC(=O)N1CCCCC1 |
| WGK Germany | 3 |
| RTECS | TM6300000 |
| Molecular Weight | 157.21 |
| Reaxy-Rn | 118408 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=118408&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Piperidines |
| Subclass | Piperidinecarboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Piperidinecarboxylic acids |
| Alternative Parents | Carbamate esters Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Piperidinecarboxylic acid - Carbamic acid ester - Carbonic acid derivative - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as piperidinecarboxylic acids. These are compounds containing a piperidine ring which bears a carboxylic acid group. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 L2416638 | Certificate of Analysis | Dec 24, 2024 | E134679 |
| K2118208 | Certificate of Analysis | Sep 14, 2023 | E134679 |
| K2118217 | Certificate of Analysis | Sep 14, 2023 | E134679 |
| K2118396 | Certificate of Analysis | Sep 14, 2023 | E134679 |
| K2118397 | Certificate of Analysis | Sep 14, 2023 | E134679 |
| Flash Point(°F) | 186.8 °F |
|---|---|
| Flash Point(°C) | 86 °C |
| Molecular Weight | 157.210 g/mol |
| XLogP3 | 1.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 157.11 Da |
| Monoisotopic Mass | 157.11 Da |
| Topological Polar Surface Area | 29.500 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 130.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
