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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 2-(3-Fluoro-4-methylphenyl)acetic acid - ≥98% , CAS No.261951-74-0
Synonyms
3-Fluoro-4-methylphenylacetic acid|261951-74-0|2-(3-fluoro-4-methylphenyl)acetic acid|Benzeneacetic acid, 3-fluoro-4-methyl-|(3-fluoro-4-methylphenyl)acetic acid|MFCD01631536|SCHEMBL283594|DTXSID30379130|YECYDEGFKJWADM-UHFFFAOYSA-N|CL9109|AKOS005258573|2-
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Why this grade ≥98% 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 Sinónimos
3-Fluoro-4-methylphenylacetic acid | 261951-74-0 | 2-(3-fluoro-4-methylphenyl)acetic acid | Benzeneacetic acid, 3-fluoro-4-methyl- | (3-fluoro-4-methylphenyl)acetic acid | MFCD01631536 | SCHEMBL283594 | DTXSID30379130 | YECYDEGFKJWADM-UHFFFAOYSA-N | CL9109 | AKOS005258573 | 2-
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488193609 Sonrisas canónicas CC1=C(C=C(C=C1)CC(=O)O)F IUPAC Name 2-(3-fluoro-4-methylphenyl)acetic acid InChIKey YECYDEGFKJWADM-UHFFFAOYSA-N INCHI 1S/C9H9FO2/c1-6-2-3-7(4-8(6)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12) Isómeros SMILES CC1=C(C=C(C=C1)CC(=O)O)F Peso molecular 168.17 Reaxy-Rn 14342919 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14342919&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 Benzenoids Clase Benzene and substituted derivatives Subclass Halobenzenes Intermediate Tree Nodes Not available Direct Parent Fluorobenzenes Alternative Parents Toluenes Aryl fluorides Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Toluene - Fluorobenzene - Aryl halide - Aryl fluoride - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring. 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 Punto de fusión (°C) 104-107℃ Peso molecular 168.160 g/mol XLogP3 1.800 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 168.059 Da Monoisotopic Mass 168.059 Da Topological Polar Surface Area 37.300 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 170.000 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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