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· · COA & SDS available for every product · Same-day shipping on in-stock items 2-(Trifluoromethyl)benzoyl chloride - ≥98% , CAS No.312-94-7
Synonyms
PS-10749 | NCIOpen2_005226 | 2-(trifluoromethyl)-1-benzenecarbonyl chloride | AKOS005254892 | F2190-0081 | NSC 88290 | AC-25992 | MFCD00000667 | NSC88290 | NSC-88290 | C8H4ClF3O | 2-trifluoromethyl benzoic acid chloride | 2-(Trifluoromethyl)benzoyl chlori
Storage
Argon charged,Room temperature
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Why this grade ≥98% 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 Application
2-(Trifluoromethyl)benzoyl chloride may be used in chemical synthesis.
Specifications Synonyms
PS-10749 | NCIOpen2_005226 | 2-(trifluoromethyl)-1-benzenecarbonyl chloride | AKOS005254892 | F2190-0081 | NSC 88290 | AC-25992 | MFCD00000667 | NSC88290 | NSC-88290 | C8H4ClF3O | 2-trifluoromethyl benzoic acid chloride | 2-(Trifluoromethyl)benzoyl chlori
Specifications & Purity
≥98%
Storage
Argon charged, Room temperature
Names and Identifiers Canonical Smiles C1=CC=C(C(=C1)C(=O)Cl)C(F)(F)F IUPAC Name 2-(trifluoromethyl)benzoyl chloride InChIKey MXIUWSYTQJLIKE-UHFFFAOYSA-N INCHI 1S/C8H4ClF3O/c9-7(13)5-3-1-2-4-6(5)8(10,11)12/h1-4H Isomeric SMILES C1=CC=C(C(=C1)C(=O)Cl)C(F)(F)F WGK Germany 3 PubChem CID 67561 UN Number 3265 Molecular Weight 208.56 Beilstein 881040 Reaxy-Rn 881040
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 Trifluoromethylbenzenes Intermediate Tree Nodes Not available Direct Parent Trifluoromethylbenzenes Alternative Parents Benzoic acids and derivatives Benzoyl derivatives Acyl chlorides Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic homomonocyclic compounds Substituents Trifluoromethylbenzene - Benzoic acid or derivatives - Benzoyl - Acyl halide - Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound Description 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.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Moisture sensitive. Refractive Index 1.479 Flash Point(°C) 105 °C Boil Point(°C) 90 °C/15 mmHg Melt Point(°C) -22 °C Molecular Weight 208.560 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 1 Exact Mass 207.99 Da Monoisotopic Mass 207.99 Da Topological Polar Surface Area 17.100 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 202.000 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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