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· · COA & SDS available for every product · Same-day shipping on in-stock items (3-Trifluoromethoxyphenyl)acetonitrile - ≥98% , CAS No.108307-56-8
Synonyms
FT-0613908 | SCHEMBL102840 | 2-[3-(trifluoromethoxy)phenyl]acetonitrile | J-511011 | MFCD00061272 | 3-(Trifluoromethoxy)phenylacetonitrile | 3-Trifluoromethoxyphenylacetonitrile | 3-trifluoromethoxybenzyl cyanide | AKOS015853154 | (3-Trifluoromethoxypheny
Storage
Room temperature,Desiccated
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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,Desiccated 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
FT-0613908 | SCHEMBL102840 | 2-[3-(trifluoromethoxy)phenyl]acetonitrile | J-511011 | MFCD00061272 | 3-(Trifluoromethoxy)phenylacetonitrile | 3-Trifluoromethoxyphenylacetonitrile | 3-trifluoromethoxybenzyl cyanide | AKOS015853154 | (3-Trifluoromethoxypheny
Specifications & Purity
≥98%
Storage
Room temperature, Desiccated
Names and Identifiers Pubchem Sid 504759003 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504759003 Canonical Smiles C1=CC(=CC(=C1)OC(F)(F)F)CC#N IUPAC Name 2-[3-(trifluoromethoxy)phenyl]acetonitrile InChIKey WZLPHJZVNJXHPV-UHFFFAOYSA-N INCHI 1S/C9H6F3NO/c10-9(11,12)14-8-3-1-2-7(6-8)4-5-13/h1-3,6H,4H2 Isomeric SMILES C1=CC(=CC(=C1)OC(F)(F)F)CC#N PubChem CID 517906 Molecular Weight 201.15
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 Benzyl cyanides Intermediate Tree Nodes Not available Direct Parent Benzyl cyanides Alternative Parents Phenoxy compounds Phenol ethers Trihalomethanes Nitriles Organopnictogen compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Benzyl-cyanide - Phenoxy compound - Phenol ether - Trihalomethane - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Halomethane - Organopnictogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as benzyl cyanides. These are organic compounds containing an acetonitrile with one hydrogen replaced by a phenyl 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 Refractive Index 1.4480 Molecular Weight 201.140 g/mol XLogP3 2.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 2 Exact Mass 201.04 Da Monoisotopic Mass 201.04 Da Topological Polar Surface Area 33.000 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 230.000 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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