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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items S-Furfuryl thioacetate - ≥99% , CAS No.13678-68-7
Synonyms
Ethanethioic Acid S-(2-Furanylmethyl) Ester | Q11317876 | 04ZX16701F | UNII-04ZX16701F | S-(2-Furanylmethyl)ethanethioate, 9CI | SCHEMBL526409 | S-Furfuryl thioacetate, 99% | FEMA No. 3162 | Furfuryl thioacetate | S-(uran-2-ylmethyl) ethanethioate | S-fur
Storage
Argon charged,Room temperature
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Why this grade ≥99% 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.
Descripción general Furfuryl thioacetate is a sulfur-containing flavor compound mainly found in coffee.
Specifications Sinónimos
Ethanethioic Acid S-(2-Furanylmethyl) Ester | Q11317876 | 04ZX16701F | UNII-04ZX16701F | S-(2-Furanylmethyl)ethanethioate, 9CI | SCHEMBL526409 | S-Furfuryl thioacetate, 99% | FEMA No. 3162 | Furfuryl thioacetate | S-(uran-2-ylmethyl) ethanethioate | S-fur
Especificaciones y pureza
≥99%
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Nombres e identificadores Sonrisas canónicas CC(=O)SCC1=CC=CO1 IUPAC Name S-(furan-2-ylmethyl) ethanethioate InChIKey LQOUTUIIYXYBQW-UHFFFAOYSA-N INCHI 1S/C7H8O2S/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H3 Isómeros SMILES CC(=O)SCC1=CC=CO1 WGK Alemania 3 Peso molecular 156.2 Reaxy-Rn 7987329 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7987329&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 Heteroaromatic compounds Subclass Not available Intermediate Tree Nodes Not available Direct Parent Heteroaromatic compounds Alternative Parents Furans Thioesters Carbothioic S-esters Sulfenyl compounds Oxacyclic compounds Carboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteromonocyclic compounds Substituents Heteroaromatic compound - Furan - Carbothioic s-ester - Thiocarboxylic acid ester - Oxacycle - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as heteroaromatic compounds. These are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom. 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 Sensibilidad Moisture sensitive Índice de refracción 1.526 Punto de inflamación (°F) 199.4 °F Punto de inflamación (°C) 93 °C Punto de ebullición (°C) 90-92°C Peso molecular 156.200 g/mol XLogP3 1.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 156.025 Da Monoisotopic Mass 156.025 Da Topological Polar Surface Area 55.500 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 125.000 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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