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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items ácido 3-[4-(etilcarbamoil)-3-fluorofenil]-4-fluorobenzoico - ≥97% , CAS No.1261909-44-7
Synonyms
1261909-44-7|4'-(Ethylcarbamoyl)-3',6-difluoro-[1,1'-biphenyl]-3-carboxylic acid|3-[4-(ETHYLCARBAMOYL)-3-FLUOROPHENYL]-4-FLUOROBENZOIC ACID|DTXSID00691912|4'-(Ethylcarbamoyl)-3',6-difluoro-[1,1'-biphenyl]-3-carboxylicacid|MFCD18322560|AKOS016008422|BS-201
Storage
Temperatura ambiente
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Temperatura ambiente 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
1261909-44-7 | 4'-(Ethylcarbamoyl)-3', 6-difluoro-[1, 1'-biphenyl]-3-carboxylic acid | 3-[4-(ETHYLCARBAMOYL)-3-FLUOROPHENYL]-4-FLUOROBENZOIC ACID | DTXSID00691912 | 4'-(Ethylcarbamoyl)-3', 6-difluoro-[1, 1'-biphenyl]-3-carboxylicacid | MFCD18322560 | AKOS016008422 | BS-201
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Temperatura ambiente
Nombres e identificadores Sonrisas canónicas CCNC(=O)C1=C(C=C(C=C1)C2=C(C=CC(=C2)C(=O)O)F)F IUPAC Name 3-[4-(ethylcarbamoyl)-3-fluorophenyl]-4-fluorobenzoic acid InChIKey ZBCMEMCAMPNWSE-UHFFFAOYSA-N INCHI 1S/C16H13F2NO3/c1-2-19-15(20)11-5-3-9(8-14(11)18)12-7-10(16(21)22)4-6-13(12)17/h3-8H,2H2,1H3,(H,19,20)(H,21,22) Isómeros SMILES CCNC(=O)C1=C(C=C(C=C1)C2=C(C=CC(=C2)C(=O)O)F)F PubChem CID 53228379 Peso molecular 305.3
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 Clase Benzene and substituted derivatives Subclass Biphenyls and derivatives Intermediate Tree Nodes Not available Direct Parent Biphenyls and derivatives Alternative Parents 2-halobenzoic acids and derivatives 4-halobenzoic acids Halobenzoic acids Benzamides Benzoic acids Benzoyl derivatives Fluorobenzenes Aryl fluorides Vinylogous halides Secondary carboxylic acid amides Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Organopnictogen compounds Organonitrogen compounds Organooxygen compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Biphenyl - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Benzamide - Benzoic acid - Benzoyl - Fluorobenzene - Halobenzene - Aryl halide - Aryl fluoride - Vinylogous halide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organohalogen compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond. 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 Peso molecular 305.280 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 4 Exact Mass 305.086 Da Monoisotopic Mass 305.086 Da Topological Polar Surface Area 66.400 Ų Heavy Atom Count 22 Formal Charge 0 Complexity 418.000 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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