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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 3-mercaptopropionato de 2-etilhexilo - ≥98% , CAS No.50448-95-8
Synonyms
(+/-)-2-ETHYLHEXYL 3-MERCAPTOPROPIONATE | 2-Formylpyrrolidine-1-carboxylic acid tert-butyl ester | DTXSID30866151 | 11-[(tert-butoxycarbonyl)amino]undecanoic acid | Propanoic acid, 3-mercapto-, 2-ethylhexyl ester | FEMA NO. 4588 | UNII-OW5186THXB | 3-MERC
Storage
Argon charged,Room temperature
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Argon charged,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
(+/-)-2-ETHYLHEXYL 3-MERCAPTOPROPIONATE | 2-Formylpyrrolidine-1-carboxylic acid tert-butyl ester | DTXSID30866151 | 11-[(tert-butoxycarbonyl)amino]undecanoic acid | Propanoic acid, 3-mercapto-, 2-ethylhexyl ester | FEMA NO. 4588 | UNII-OW5186THXB | 3-MERC
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Nombres e identificadores Pubchem Sid 488186713 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488186713 Sonrisas canónicas CCCCC(CC)COC(=O)CCS IUPAC Name 2-ethylhexyl 3-sulfanylpropanoate InChIKey SUODCTNNAKSRHB-UHFFFAOYSA-N INCHI 1S/C11H22O2S/c1-3-5-6-10(4-2)9-13-11(12)7-8-14/h10,14H,3-9H2,1-2H3 Isómeros SMILES CCCCC(CC)COC(=O)CCS Peso molecular 218.36 Reaxy-Rn 1862038 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1862038&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 Organic acids and derivatives Clase Carboxylic acids and derivatives Subclass Carboxylic acid derivatives Intermediate Tree Nodes Not available Direct Parent Carboxylic acid esters Alternative Parents Monocarboxylic acids and derivatives Alkylthiols Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic acyclic compounds Substituents Carboxylic acid ester - Monocarboxylic acid or derivatives - Alkylthiol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound Descripción This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Insoluble in water; Very soluble in Acetone,Ethanol,Toluene Sensibilidad Air Sensitive,Moisture Sensitive Índice de refracción 1.46 Punto de inflamación (°C) 125°C(lit.) Peso molecular 218.360 g/mol XLogP3 3.500 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 9 Exact Mass 218.134 Da Monoisotopic Mass 218.134 Da Topological Polar Surface Area 27.300 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 148.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
Calculadoras de soluciones Molarity Calculator Determine the necessary mass, volume, or concentration for preparing a solution.
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Reconstitution Calculator Reseñas Artículos relacionados Trimethylolpropane Tris(3-mercaptopropionate) - ≥85%(GC) , CAS No.33007-83-9
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