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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 6-(trifluoromethyl)-1H-indole-2-carboxylate - ≥96% , CAS No.327-21-9
Synonyms
Ethyl 6-(trifluoromethyl)-1H-indole-2-carboxylate|327-21-9|ethyl 6-(trifluoromethyl)-indole-2-carboxylate|ethyl 6-(trifluoromethyl)indole-2-carboxylate|MFCD09833401|SCHEMBL2139103|DTXSID50624614|1H-Indole-2-carboxylic acid, 6-(trifluoromethyl)-, ethyl est
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Why this grade ≥96% 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
Ethyl 6-(trifluoromethyl)-1H-indole-2-carboxylate | 327-21-9 | ethyl 6-(trifluoromethyl)-indole-2-carboxylate | ethyl 6-(trifluoromethyl)indole-2-carboxylate | MFCD09833401 | SCHEMBL2139103 | DTXSID50624614 | 1H-Indole-2-carboxylic acid, 6-(trifluoromethyl)-, ethyl est
Specifications & Purity
≥96%
Names and Identifiers Canonical Smiles CCOC(=O)C1=CC2=C(N1)C=C(C=C2)C(F)(F)F IUPAC Name ethyl 6-(trifluoromethyl)-1H-indole-2-carboxylate InChIKey MIBFONNBTQRYGN-UHFFFAOYSA-N INCHI 1S/C12H10F3NO2/c1-2-18-11(17)10-5-7-3-4-8(12(13,14)15)6-9(7)16-10/h3-6,16H,2H2,1H3 Isomeric SMILES CCOC(=O)C1=CC2=C(N1)C=C(C=C2)C(F)(F)F Molecular Weight 257.21 Reaxy-Rn 251429 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=251429&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 Indoles and derivatives Subclass Indolecarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Indolecarboxylic acids and derivatives Alternative Parents Indoles Pyrrole carboxylic acids and derivatives Substituted pyrroles Benzenoids Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic heteropolycyclic compounds Substituents Indolecarboxylic acid derivative - Indole - Pyrrole-2-carboxylic acid or derivatives - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole. 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 257.209 g/mol XLogP3 4.100 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 3 Exact Mass 257.066 Da Monoisotopic Mass 257.066 Da Topological Polar Surface Area 42.100 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 319.000 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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