The store will not work correctly when cookies are disabled.
JavaScript seems to be disabled in your browser. For the best experience on our site, be sure to turn on Javascript in your browser.
· · COA & SDS available for every product · Same-day shipping on in-stock items 5-(4-Carboxy-3-fluorophenyl)-2-cyanophenol - ≥96% , CAS No.1261964-35-5
Synonyms
4'-Cyano-3-fluoro-3'-hydroxy-[1,1'-biphenyl]-4-carboxylic acid | 4'-Cyano-3-fluoro-3'-hydroxy[1,1'-biphenyl]-4-carboxylic acid | [1,1'-Biphenyl]-4-carboxylic acid, 4'-cyano-3-fluoro-3'-hydroxy- | 4'-Cyano-3-fluoro-3'-hydroxy-[1,1'-biphenyl]-4-carboxylicac
🧪
Why this grade ≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
🌡
Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
📋
Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
📚
Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
4'-Cyano-3-fluoro-3'-hydroxy-[1, 1'-biphenyl]-4-carboxylic acid | 4'-Cyano-3-fluoro-3'-hydroxy[1, 1'-biphenyl]-4-carboxylic acid | [1, 1'-Biphenyl]-4-carboxylic acid, 4'-cyano-3-fluoro-3'-hydroxy- | 4'-Cyano-3-fluoro-3'-hydroxy-[1, 1'-biphenyl]-4-carboxylicac
Specifications & Purity
≥96%
Names and Identifiers Canonical Smiles C1=CC(=C(C=C1C2=CC(=C(C=C2)C(=O)O)F)O)C#N IUPAC Name 4-(4-cyano-3-hydroxyphenyl)-2-fluorobenzoic acid InChIKey FUQIYGVUFPSIRX-UHFFFAOYSA-N INCHI 1S/C14H8FNO3/c15-12-5-8(3-4-11(12)14(18)19)9-1-2-10(7-16)13(17)6-9/h1-6,17H,(H,18,19) Isomeric SMILES C1=CC(=C(C=C1C2=CC(=C(C=C2)C(=O)O)F)O)C#N PubChem CID 53220096 Molecular Weight 257.2
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 Biphenyls and derivatives Intermediate Tree Nodes Not available Direct Parent Biphenylcarbonitriles Alternative Parents 2-halobenzoic acids Halobenzoic acids Benzoic acids 1-carboxy-2-haloaromatic compounds Benzonitriles Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Fluorobenzenes Aryl fluorides Vinylogous halides Nitriles Organic oxides Organofluorides Organooxygen compounds Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Biphenylcarbonitrile - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Benzoic acid - 1-carboxy-2-haloaromatic compound - Benzonitrile - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Phenol - Fluorobenzene - Aryl halide - Aryl fluoride - Vinylogous halide - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organofluoride - Organic oxygen compound - Organopnictogen compound - Organohalogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as biphenylcarbonitriles. These are organic compounds containing an acetonitrile with one hydrogen replaced by a biphenyl group. 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 257.220 g/mol XLogP3 3.100 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 2 Exact Mass 257.049 Da Monoisotopic Mass 257.049 Da Topological Polar Surface Area 81.300 Ų Heavy Atom Count 19 Formal Charge 0 Complexity 391.000 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
Solution Calculators Molarity Calculator Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator Reviews
We use cookies to ensure the website functions properly and, where permitted, to improve your experience. You can manage your preferences at any time in Settings. Learn more in our
Cookie Policy. Settings Agree All Decline
Shall we send you a message when we have discounts available?
Remind me later Allow
Thank you! Please check your email inbox to confirm.
Oops! Notifications are disabled.
Products are supplied to verified businesses, institutions, and qualified professionals for research and development use only. Not for use in humans, animals, diagnosis, or therapy.
Copyright © 2023–present Aladdin Scientific Corp. All rights reserved.
