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· · COA & SDS available for every product · Same-day shipping on in-stock items trans-4-(Trifluoromethyl)cyclohexanecarboxylic Acid - ≥98% , CAS No.133261-33-3
Synonyms
(1r,4r)-4-(trifluoromethyl)cyclohexane-1-carboxylic acid | A888144 | MFCD09037361 | TRANS-4-TRIFLUOROMETHYLCYCLOHEXANECARBOXYLIC ACID | trans-4-Trifluoromethyl-cyclohexanecarboxylic acid | trans-4-trifluoromethyl-cyclohexane-carboxylic acid | J-006340 | 4
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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 Synonyms
(1r, 4r)-4-(trifluoromethyl)cyclohexane-1-carboxylic acid | A888144 | MFCD09037361 | TRANS-4-TRIFLUOROMETHYLCYCLOHEXANECARBOXYLIC ACID | trans-4-Trifluoromethyl-cyclohexanecarboxylic acid | trans-4-trifluoromethyl-cyclohexane-carboxylic acid | J-006340 | 4
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 508812780 Canonical Smiles C1CC(CCC1C(=O)O)C(F)(F)F IUPAC Name 4-(trifluoromethyl)cyclohexane-1-carboxylic acid InChIKey LMEAZIIFLVDISW-UHFFFAOYSA-N INCHI 1S/C8H11F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h5-6H,1-4H2,(H,12,13) Isomeric SMILES C1CC(CCC1C(=O)O)C(F)(F)F WGK Germany 3 Molecular Weight 196.17 Reaxy-Rn 5510857 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5510857&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 Organic acids and derivatives Class Carboxylic acids and derivatives Subclass Carboxylic acids Intermediate Tree Nodes Not available Direct Parent Carboxylic acids Alternative Parents Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Molecular Framework Aliphatic homomonocyclic compounds Substituents Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH. 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 Solubility Soluble in Methanol Melt Point(°C) 151-156°C Molecular Weight 196.170 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 1 Exact Mass 196.071 Da Monoisotopic Mass 196.071 Da Topological Polar Surface Area 37.300 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 192.000 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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