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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-[(2,5-dimethylfuran-3-carbonyl)amino]benzoic acid - ≥97% , CAS No.346579-89-3
Synonyms
3-[(2,5-Dimethyl-furan-3-carbonyl)-amino]-benzoic acid | 3-(2,5-Dimethylfuran-3-carboxamido)benzoic acid | 3-[(2,5-dimethylfuran-3-carbonyl)amino]benzoic acid | 3-((2,5-dimethylfuran-3-carbonyl)amino)benzoic acid | SMR000123720 | CBMicro_034774 | Cambridg
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Why this grade ≥97% 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.
Specifications Synonyms
3-[(2, 5-Dimethyl-furan-3-carbonyl)-amino]-benzoic acid | 3-(2, 5-Dimethylfuran-3-carboxamido)benzoic acid | 3-[(2, 5-dimethylfuran-3-carbonyl)amino]benzoic acid | 3-((2, 5-dimethylfuran-3-carbonyl)amino)benzoic acid | SMR000123720 | CBMicro_034774 | Cambridg
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles CC1=CC(=C(O1)C)C(=O)NC2=CC=CC(=C2)C(=O)O IUPAC Name 3-[(2,5-dimethylfuran-3-carbonyl)amino]benzoic acid InChIKey MRKCFCRNCNACNW-UHFFFAOYSA-N INCHI 1S/C14H13NO4/c1-8-6-12(9(2)19-8)13(16)15-11-5-3-4-10(7-11)14(17)18/h3-7H,1-2H3,(H,15,16)(H,17,18) Isomeric SMILES CC1=CC(=C(O1)C)C(=O)NC2=CC=CC(=C2)C(=O)O PubChem CID 798035 Molecular Weight 259.26
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 Benzenoids Class Benzene and substituted derivatives Subclass Anilides Intermediate Tree Nodes Aromatic anilides - Furanilides Direct Parent 3-furanilides Alternative Parents Benzoic acids Furan-3-carboxylic acid and derivatives Benzoyl derivatives Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents 3-furanilide - Benzoic acid or derivatives - Benzoic acid - Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - Benzoyl - Furan - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as 3-furanilides. These are aromatic heterocyclic compounds contaning a furan ring that is substituted at the 3-position with an anilide. 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 Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 259.260 g/mol XLogP3 2.100 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 259.084 Da Monoisotopic Mass 259.084 Da Topological Polar Surface Area 79.500 Ų Heavy Atom Count 19 Formal Charge 0 Complexity 357.000 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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