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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Ethyl 4-chloroquinoline-3-carboxylate - ≥98% , CAS No.13720-94-0
Synonyms
5-Benzyl-3-furylmethyl(+)-trans-chrysanthemate | Ethyl 4-chloroquinoline-3-carboxylate, AldrichCPR | J-650263 | AC-2908 | ETHYL4-CHLOROQUINOLINE-3-CARBOXYLATE | FT-0618262 | MFCD00173407 | SY003320 | NSC-136916 | SCHEMBL776014 | 6J-051 | STK711101 | Bione
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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 Sinónimos
5-Benzyl-3-furylmethyl(+)-trans-chrysanthemate | Ethyl 4-chloroquinoline-3-carboxylate, AldrichCPR | J-650263 | AC-2908 | ETHYL4-CHLOROQUINOLINE-3-CARBOXYLATE | FT-0618262 | MFCD00173407 | SY003320 | NSC-136916 | SCHEMBL776014 | 6J-051 | STK711101 | Bione
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488189176 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488189176 Sonrisas canónicas CCOC(=O)C1=C(C2=CC=CC=C2N=C1)Cl IUPAC Name ethyl 4-chloroquinoline-3-carboxylate InChIKey DWXQUAHMZWZXHP-UHFFFAOYSA-N INCHI 1S/C12H10ClNO2/c1-2-16-12(15)9-7-14-10-6-4-3-5-8(10)11(9)13/h3-7H,2H2,1H3 Isómeros SMILES CCOC(=O)C1=C(C2=CC=CC=C2N=C1)Cl Peso molecular 235.7 Reaxy-Rn 179435 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=179435&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 Clase Quinolines and derivatives Subclass Haloquinolines Intermediate Tree Nodes Not available Direct Parent Chloroquinolines Alternative Parents Pyridinecarboxylic acids Benzenoids Aryl chlorides Vinylogous halides 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 heteropolycyclic compounds Substituents Chloroquinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous halide - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound Descripción This compound belongs to the class of organic compounds known as chloroquinolines. These are compounds containing a quinoline moiety, which carries one or more chlorine 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Punto de ebullición (°C) 129 °C/0.2 mmHg Punto de fusión (°C) 46 °C Peso molecular 235.660 g/mol XLogP3 3.000 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 235.04 Da Monoisotopic Mass 235.04 Da Topological Polar Surface Area 39.200 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 259.000 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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