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· · COA & SDS available for every product · Same-day shipping on in-stock items ethyl 1,2,3,4-tetrahydropyridine-5-carboxylate - ≥97% , CAS No.3335-05-5
Synonyms
SY323306 | ethyl 1,4,5,6-tetrahydroni-cotinate | 1,4,5,6-tetrahydro-pyridine-3-carboxylic acid ethyl ester | NSC93736 | NSC-93736 | SCHEMBL2640643 | DTXSID40294042 | 3-Pyridinecarboxylic acid, 1,4,5,6-tetrahydro-, ethyl ester | ethyl 1,2,3,4-tetrahydropyr
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping 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.
Specifications Synonyms
SY323306 | ethyl 1, 4, 5, 6-tetrahydroni-cotinate | 1, 4, 5, 6-tetrahydro-pyridine-3-carboxylic acid ethyl ester | NSC93736 | NSC-93736 | SCHEMBL2640643 | DTXSID40294042 | 3-Pyridinecarboxylic acid, 1, 4, 5, 6-tetrahydro-, ethyl ester | ethyl 1, 2, 3, 4-tetrahydropyr
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles CCOC(=O)C1=CNCCC1 IUPAC Name ethyl 1,2,3,4-tetrahydropyridine-5-carboxylate InChIKey DYPMGDXWHGOTNI-UHFFFAOYSA-N INCHI 1S/C8H13NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h6,9H,2-5H2,1H3 Isomeric SMILES CCOC(=O)C1=CNCCC1 Alternate CAS 3335-05-5 PubChem CID 261490 NSC Number 93736 Molecular Weight 155.19
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 Pyridines and derivatives Subclass Hydropyridines Intermediate Tree Nodes Not available Direct Parent Tetrahydropyridines Alternative Parents Vinylogous amides Enoate esters Amino acids and derivatives Monocarboxylic acids and derivatives Enamines Dialkylamines Azacyclic compounds Allylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Tetrahydropyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Monocarboxylic acid or derivatives - Secondary amine - Allylamine - Azacycle - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Amine - Aliphatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as tetrahydropyridines. These are derivatives of pyridine in which two double bonds in the pyridine moiety are reduced by adding four hydrogen atoms. 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 Molecular Weight 155.190 g/mol XLogP3 1.100 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 155.095 Da Monoisotopic Mass 155.095 Da Topological Polar Surface Area 38.300 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 175.000 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
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