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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-(Trifluoromethoxy)benzonitrile - ≥98%(GC) , CAS No.332-25-2
Synonyms
T2292 | A1649 | PS-8460 | DTXSID5073163 | m-trifluoromethoxybenzyl amine | AC-17046 | EN300-112012 | p-cyanotrifluoromethoxybenzene | p-(trifluoromethoxy)benzonitrile | 4-(Trifluoromethoxy)benzonitrile | STK801380 | AM61474 | A22228 | EINECS 206-363-3 | S
Storage
Argon charged,Room temperature
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Why this grade ≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Argon charged,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.
Overview 4-(Trifluoromethoxy)benzonitrile serves as an intermediate in the synthesis of fluvoxamine.
Specifications Synonyms
T2292 | A1649 | PS-8460 | DTXSID5073163 | m-trifluoromethoxybenzyl amine | AC-17046 | EN300-112012 | p-cyanotrifluoromethoxybenzene | p-(trifluoromethoxy)benzonitrile | 4-(Trifluoromethoxy)benzonitrile | STK801380 | AM61474 | A22228 | EINECS 206-363-3 | S
Specifications & Purity
≥98%(GC)
Storage
Argon charged, Room temperature
Names and Identifiers Pubchem Sid 488183968 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488183968 Canonical Smiles C1=CC(=CC=C1C#N)OC(F)(F)F IUPAC Name 4-(trifluoromethoxy)benzonitrile InChIKey XWHIXOMWXCHJPP-UHFFFAOYSA-N INCHI 1S/C8H4F3NO/c9-8(10,11)13-7-3-1-6(5-12)2-4-7/h1-4H Isomeric SMILES C1=CC(=CC=C1C#N)OC(F)(F)F WGK Germany 3 PubChem CID 67621 Molecular Weight 187.12 Beilstein 10(4)444 Reaxy-Rn 2832939
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 Phenol ethers Subclass Not available Intermediate Tree Nodes Not available Direct Parent Phenol ethers Alternative Parents Phenoxy compounds Benzonitriles Trihalomethanes Nitriles Organopnictogen compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Phenoxy compound - Benzonitrile - Phenol ether - Monocyclic benzene moiety - Trihalomethane - Carbonitrile - Nitrile - Alkyl fluoride - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Halomethane - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with 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.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Air Sensitive Refractive Index 1.452 Flash Point(°F) 181.4 °F Flash Point(°C) 83°C(lit.) Boil Point(°C) 195-196℃ Molecular Weight 187.120 g/mol XLogP3 2.800 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 1 Exact Mass 187.024 Da Monoisotopic Mass 187.024 Da Topological Polar Surface Area 33.000 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 209.000 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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