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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 2-Amino-6-trifluoromethylbenzonitrile - ≥98% , CAS No.58458-11-0
Synonyms
SY104138 | A856517 | 2-amino-6-trifluoromethylbenzonitrile | 2-cyano-3-trifluoromethylaniline | MFCD08741381 | FT-0707588 | 2-Amino-6-(trifluoromethyl)benzonitrile | PS-8480 | 2-Amino-6-trifluoromethylbenzenecarbonitrile | CL8151 | DTXSID20627056 | AKOS02
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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
SY104138 | A856517 | 2-amino-6-trifluoromethylbenzonitrile | 2-cyano-3-trifluoromethylaniline | MFCD08741381 | FT-0707588 | 2-Amino-6-(trifluoromethyl)benzonitrile | PS-8480 | 2-Amino-6-trifluoromethylbenzenecarbonitrile | CL8151 | DTXSID20627056 | AKOS02
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 504769263 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504769263 Sonrisas canónicas C1=CC(=C(C(=C1)N)C#N)C(F)(F)F IUPAC Name 2-amino-6-(trifluoromethyl)benzonitrile InChIKey HKKKKTUZACXWLU-UHFFFAOYSA-N INCHI 1S/C8H5F3N2/c9-8(10,11)6-2-1-3-7(13)5(6)4-12/h1-3H,13H2 Isómeros SMILES C1=CC(=C(C(=C1)N)C#N)C(F)(F)F Peso molecular 186.1 Reaxy-Rn 13266254 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13266254&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 Benzonitriles Aniline and substituted anilines Nitriles Primary amines Organofluorides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Trifluoromethylbenzene - Benzonitrile - Aniline or substituted anilines - Carbonitrile - Nitrile - Alkyl fluoride - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Amine - Alkyl halide - 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 Peso molecular 186.130 g/mol XLogP3 2.400 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 0 Exact Mass 186.04 Da Monoisotopic Mass 186.04 Da Topological Polar Surface Area 49.800 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 227.000 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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