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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 2-chloroisonicotinate - ≥98% , CAS No.54453-93-9
Synonyms
DTXSID00376595 | Ethyl2-chloroisonicotinate | STK503455 | AKOS004910655 | ETHYL-2-CHLOROPYRIDINE-4-CARBOXYLATE | ethyl2-chloropyridine-4-carboxylate | EN300-1252633 | IGRLNCOFYMWKBU-UHFFFAOYSA-N | FT-0647687 | Z293052298 | AM20061701 | ethyl 2-chloroisoni
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Why this grade ≥98% 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
DTXSID00376595 | Ethyl2-chloroisonicotinate | STK503455 | AKOS004910655 | ETHYL-2-CHLOROPYRIDINE-4-CARBOXYLATE | ethyl2-chloropyridine-4-carboxylate | EN300-1252633 | IGRLNCOFYMWKBU-UHFFFAOYSA-N | FT-0647687 | Z293052298 | AM20061701 | ethyl 2-chloroisoni
Specifications & Purity
≥98%
Names and Identifiers Canonical Smiles CCOC(=O)C1=CC(=NC=C1)Cl IUPAC Name ethyl 2-chloropyridine-4-carboxylate InChIKey IGRLNCOFYMWKBU-UHFFFAOYSA-N INCHI 1S/C8H8ClNO2/c1-2-12-8(11)6-3-4-10-7(9)5-6/h3-5H,2H2,1H3 Isomeric SMILES CCOC(=O)C1=CC(=NC=C1)Cl Molecular Weight 185.61 Reaxy-Rn 388832 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=388832&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 Pyridines and derivatives Subclass Pyridinecarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Pyridinecarboxylic acids Alternative Parents 2-halopyridines Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Pyridine carboxylic acid - 2-halopyridine - Aryl chloride - Aryl halide - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group. 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 Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 185.610 g/mol XLogP3 1.800 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 185.024 Da Monoisotopic Mass 185.024 Da Topological Polar Surface Area 39.200 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 163.000 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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