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· · COA & SDS Disponível para todos os produtos · Envio no mesmo dia em itens em estoque Ethyl 3-indoleacetate - ≥98% , CAS No.778-82-5
Disponível para encomenda
Synonyms
(1H-INDOL-3-YL)ACETIC ACID ETHYL ESTER | (1H-Indol-3-yl)-acetic acid ethyl ester | Ethyl indole-3-acetate | MLS000046040 | I-1100 | DS-15297 | 5-22-03-00067 (Beilstein Handbook Reference) | 3-((ETHOXYCARBONYL)METHYL)INDOLE | Ethyl 3-indoleacetate;Ethyl 2-
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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.
Visão geral Reactant for preparation of;Pesticides;Anti-inflammatory agents;Antibacterial and antifungal agents;Anticonvulsant agents;Hypotensive agents;Analgesic agents.
Specifications Sinónimos
(1H-INDOL-3-YL)ACETIC ACID ETHYL ESTER | (1H-Indol-3-yl)-acetic acid ethyl ester | Ethyl indole-3-acetate | MLS000046040 | I-1100 | DS-15297 | 5-22-03-00067 (Beilstein Handbook Reference) | 3-((ETHOXYCARBONYL)METHYL)INDOLE | Ethyl 3-indoleacetate;Ethyl 2-
Especificações e pureza
≥98%
Condições de armazenamento de armazenamento
Room temperature
Nomes e identificadores Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488181786
Sorrisos canónicos
CCOC(=O)CC1=CNC2=CC=CC=C21
IUPAC Name
ethyl 2-(1H-indol-3-yl)acetate
InChIKey
HUDBDWIQSIGUDI-UHFFFAOYSA-N
INCHI
1S/C12H13NO2/c1-2-15-12(14)7-9-8-13-11-6-4-3-5-10(9)11/h3-6,8,13H,2,7H2,1H3
SMILES isoméricas
CCOC(=O)CC1=CNC2=CC=CC=C21
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=171682&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 Classe Indoles and derivatives Subclass Indolyl carboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Indole-3-acetic acid derivatives Alternative Parents 3-alkylindoles Substituted pyrroles Benzenoids Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents Indole-3-acetic acid derivative - 3-alkylindole - Indole - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound Descrição This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of 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.
Estrutura 3D Alvos associados (humanos) Alvos associados (não humanos) Mecanismos de ação Certificados（CoA,COO,BSE/TSE e Mapa de Análise) Propriedades químicas e físicas Solubilidade Soluble in Methanol Sensibilidade Heat sensitive. Ponto de inflamação (°F) 235.4 °F Ponto de inflamação (°C) 113 °C Ponto de ebulição (°C) 164-166 °C Ponto de fusão (°C) 44-45°C Peso molecular 203.240 g/mol XLogP3 2.100 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 4 Exact Mass 203.095 Da Monoisotopic Mass 203.095 Da Topological Polar Surface Area 42.100 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 230.000 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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