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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 5-Furfurylidene-2-Thiobarbituric Acid , CAS No.27430-18-8
Synonyms
5-Furfurylidene-2-Thiobarbituric Acid | NSC-96626 | 5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione | 5-FURFURYLIDENE-2-THIOBARBITURICACID | 5-[(Furan-2-yl)methylidene]-4,6-dihydroxy-2,5-dihydropyrimidine-2-thione | 5-[(furan-2-yl)methyl
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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
5-Furfurylidene-2-Thiobarbituric Acid | NSC-96626 | 5-(furan-2-ylmethylidene)-2-sulfanylidene-1, 3-diazinane-4, 6-dione | 5-FURFURYLIDENE-2-THIOBARBITURICACID | 5-[(Furan-2-yl)methylidene]-4, 6-dihydroxy-2, 5-dihydropyrimidine-2-thione | 5-[(furan-2-yl)methyl
Condiciones de almacenamiento de almacenamiento
Room temperature
Propiedades del producto Nombres e identificadores Sonrisas canónicas C1=COC(=C1)C=C2C(=O)NC(=S)NC2=O IUPAC Name 5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione InChIKey VQRARDATQWRHGF-UHFFFAOYSA-N INCHI 1S/C9H6N2O3S/c12-7-6(4-5-2-1-3-14-5)8(13)11-9(15)10-7/h1-4H,(H2,10,11,12,13,15) Isómeros SMILES C1=COC(=C1)C=C2C(=O)NC(=S)NC2=O PubChem CID 676561 Peso molecular 222.22
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 Diazines Subclass Pyrimidines and pyrimidine derivatives Intermediate Tree Nodes Pyrimidones Direct Parent Thiobarbituric acid derivatives Alternative Parents Diazinanes Heteroaromatic compounds Furans Thioureas Oxacyclic compounds Carboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteromonocyclic compounds Substituents Thiobarbiturate - 1,3-diazinane - Furan - Heteroaromatic compound - Thiourea - Oxacycle - Azacycle - Carboxylic acid derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as thiobarbituric acid derivatives. These are organic compounds containing a 2-thioxodihydropyrimidine-4,6(1H,5H)-dione skeleton. 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 Objetivos asociados (humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 222.220 g/mol XLogP3 0.700 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 1 Exact Mass 222.01 Da Monoisotopic Mass 222.01 Da Topological Polar Surface Area 103.000 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 342.000 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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