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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 2-Chloro-5-(trifluoromethyl)phenol - ≥98% , CAS No.40889-91-6
Synonyms
STK336727 | 2-chloranyl-5-(trifluoromethyl)phenol | C2947 | AM61536 | FT-0618068 | SCHEMBL226137 | A826283 | D89526 | MFCD00019995 | BB 0244817 | DTXSID40193884 | 2-Chloro-5-(trifluoromethyl)phenol, 96% | EN300-22400 | 2-Chloro-5-trifluoromethylphenol | 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
STK336727 | 2-chloranyl-5-(trifluoromethyl)phenol | C2947 | AM61536 | FT-0618068 | SCHEMBL226137 | A826283 | D89526 | MFCD00019995 | BB 0244817 | DTXSID40193884 | 2-Chloro-5-(trifluoromethyl)phenol, 96% | EN300-22400 | 2-Chloro-5-trifluoromethylphenol | 2
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488187750 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488187750 Sonrisas canónicas C1=CC(=C(C=C1C(F)(F)F)O)Cl IUPAC Name 2-chloro-5-(trifluoromethyl)phenol InChIKey SUIZARUATMVYRT-UHFFFAOYSA-N INCHI 1S/C7H4ClF3O/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3,12H Isómeros SMILES C1=CC(=C(C=C1C(F)(F)F)O)Cl WGK Alemania 3 Número ONU 1993 Peso molecular 196.55 Beilstein 2094176 Reaxy-Rn 2094176 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2094176&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 Trifluoromethylbenzenes Intermediate Tree Nodes Not available Direct Parent Trifluoromethylbenzenes Alternative Parents O-chlorophenols Chlorobenzenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Organooxygen compounds Organofluorides Organochlorides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Trifluoromethylbenzene - 2-halophenol - 2-chlorophenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Phenol - Aryl chloride - Aryl halide - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups. 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 Índice de refracción 1.473 Punto de inflamación (°F) 114.8 °F Punto de inflamación (°C) 46°(114°F) Punto de ebullición (°C) 87-88°C/38mmHg Peso molecular 196.550 g/mol XLogP3 3.400 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 0 Exact Mass 195.99 Da Monoisotopic Mass 195.99 Da Topological Polar Surface Area 20.200 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 159.000 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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