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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 1-Benzyl-3-oxo-4-piperidinecarboxylate Hydrochloride - ≥98% , CAS No.52763-21-0
Synonyms
ethyl 3-oxo-1-(phenylmethyl)-piperidine-4-carboxylate hydrochloride | 1-Benzyl-3-oxo-4-piperidinecarboxylic Acid Ethyl Ester Hydrochloride | Ethyl N-benzyl-3-oxopiperidine-4-carboxylate hydrochloride | 1-benzyl-4-carbethoxy-3-oxo-piperidine-hydrochloride
Storage
Argon charged,Room temperature
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Overview Ethyl 1-benzyl-3-oxo-4-piperidinecarboxylate hydrochloride was used as building block for the syntheses of receptor agonists and antagonists.
Specifications Synonyms
ethyl 3-oxo-1-(phenylmethyl)-piperidine-4-carboxylate hydrochloride | 1-Benzyl-3-oxo-4-piperidinecarboxylic Acid Ethyl Ester Hydrochloride | Ethyl N-benzyl-3-oxopiperidine-4-carboxylate hydrochloride | 1-benzyl-4-carbethoxy-3-oxo-piperidine-hydrochloride
Specifications & Purity
≥98%
Storage
Argon charged, Room temperature
Names and Identifiers Pubchem Sid 504760825 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504760825 Canonical Smiles CCOC(=O)C1CCN(CC1=O)CC2=CC=CC=C2.Cl IUPAC Name ethyl 1-benzyl-3-oxopiperidine-4-carboxylate;hydrochloride InChIKey UQOMEAWPKSISII-UHFFFAOYSA-N INCHI 1S/C15H19NO3.ClH/c1-2-19-15(18)13-8-9-16(11-14(13)17)10-12-6-4-3-5-7-12;/h3-7,13H,2,8-11H2,1H3;1H Isomeric SMILES CCOC(=O)C1CCN(CC1=O)CC2=CC=CC=C2.Cl WGK Germany 3 Molecular Weight 297.78 Beilstein 22(4)2913 Reaxy-Rn 3749159 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3749159&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Piperidines Subclass Benzylpiperidines Intermediate Tree Nodes Not available Direct Parent N-benzylpiperidines Alternative Parents Piperidinecarboxylic acids Benzylamines Phenylmethylamines Aralkylamines Piperidinones 1,3-dicarbonyl compounds Amino acids and derivatives Cyclic ketones Carboxylic acid esters Trialkylamines Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents N-benzylpiperidine - Piperidinecarboxylic acid - Benzylamine - Phenylmethylamine - Piperidinone - Aralkylamine - Benzenoid - 1,3-dicarbonyl compound - Monocyclic benzene moiety - Amino acid or derivatives - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Ketone - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Amine - Hydrochloride - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Moisture sensitive Melt Point(°C) 165 °C(dec.) Molecular Weight 297.780 g/mol XLogP3 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 5 Exact Mass 297.113 Da Monoisotopic Mass 297.113 Da Topological Polar Surface Area 46.600 Ų Heavy Atom Count 20 Formal Charge 0 Complexity 323.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 2
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