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· · COA & SDS available for every product · Same-day shipping on in-stock items Ethyl 4,5,6,7-Tetrahydroisoindole-1-carboxylate - ≥95%(GC) , CAS No.65880-17-3
Synonyms
DTXSID20434484 | AKOS006294325 | E0857 | 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid ethyl ester | 2-carbethoxy-3,4-tetramethylenepyrrole | SY054170 | TS-02742 | SCHEMBL469817 | Ethyl 4,5,6,7-Tetrahydroisoindole-1-carboxylate | 4,5,6,7-Tetrahydroiso
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Why this grade ≥95%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice 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
DTXSID20434484 | AKOS006294325 | E0857 | 4, 5, 6, 7-tetrahydro-2H-isoindole-1-carboxylic acid ethyl ester | 2-carbethoxy-3, 4-tetramethylenepyrrole | SY054170 | TS-02742 | SCHEMBL469817 | Ethyl 4, 5, 6, 7-Tetrahydroisoindole-1-carboxylate | 4, 5, 6, 7-Tetrahydroiso
Specifications & Purity
≥95%(GC)
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504765205 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504765205 Canonical Smiles CCOC(=O)C1=C2CCCCC2=CN1 IUPAC Name ethyl 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylate InChIKey NIMDFIORBNYIGB-UHFFFAOYSA-N INCHI 1S/C11H15NO2/c1-2-14-11(13)10-9-6-4-3-5-8(9)7-12-10/h7,12H,2-6H2,1H3 Isomeric SMILES CCOC(=O)C1=C2CCCCC2=CN1 Molecular Weight 193.25 Reaxy-Rn 393243 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=393243&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 Isoindoles and derivatives Subclass Isoindoles Intermediate Tree Nodes Not available Direct Parent Isoindoles Alternative Parents Pyrrole carboxylic acids and derivatives Substituted pyrroles Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Isoindole - Pyrrole-2-carboxylic acid or derivatives - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as isoindoles. These are heteropolycyclic compounds with a structure containing isoindole, a benzo-fused pyrrole. 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 Sensitivity Air Sensitive,Heat Sensitive Melt Point(°C) 79 °C Molecular Weight 193.240 g/mol XLogP3 2.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 3 Exact Mass 193.11 Da Monoisotopic Mass 193.11 Da Topological Polar Surface Area 42.100 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 217.000 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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