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· · COA & SDS available for every product · Same-day shipping on in-stock items Acetophenone - AR, ≥98%(GC) , CAS No.98-86-2
GRADE & PURITY AR ? Analytical Reagent grade — high-purity chemicals meeting strict assay limits for lab analysis. Use when accuracy matters and trace impurities could skew results. ≥98%(GC) Synonyms
FT-0637564 | MFCD00008724 | alpha-Acetophenone | MFCD00064447 | RK493WHV10 | 1-Phenylethanone (acetophenone) | Benzoylmethide | Tox21_300343 | ACETOPHENONE [FHFI] | acetyl-benzen | Acetylbenzene | Acetyl-Benzene | Ethanone-2,2,2-d3, 1-(phenyl-d5)- | HY-Y0
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Why this grade AR, ≥98%(GC) AR 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 129 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
FT-0637564 | MFCD00008724 | alpha-Acetophenone | MFCD00064447 | RK493WHV10 | 1-Phenylethanone (acetophenone) | Benzoylmethide | Tox21_300343 | ACETOPHENONE [FHFI] | acetyl-benzen | Acetylbenzene | Acetyl-Benzene | Ethanone-2,2,2-d3, 1-(phenyl-d5)- | HY-Y0
Specifications & Purity
AR, ≥98%(GC)
Names and Identifiers Pubchem Sid 508816378 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/508816378 Canonical Smiles CC(=O)C1=CC=CC=C1 IUPAC Name 1-phenylethanone InChIKey KWOLFJPFCHCOCG-UHFFFAOYSA-N INCHI 1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3 Isomeric SMILES CC(=O)C1=CC=CC=C1 WGK Germany 1 RTECS AM5250000 UN Number 1993 Packing Group I Molecular Weight 120.15 Beilstein 605842 Reaxy-Rn 605842 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605842&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 Organic oxygen compounds Class Organooxygen compounds Subclass Carbonyl compounds Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones Direct Parent Alkyl-phenylketones Alternative Parents Acetophenones Benzoyl derivatives Aryl alkyl ketones Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Alkyl-phenylketone - Acetophenone - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. External Descriptors an aromatic compound - a methyl-ethyl-ketone 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 Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Solubility in water: Practically Insoluble; Degree of Solubility in water: 6,130 mg/l 25 °C; Miscible with Chloroform,Ether,Alcohol; Soluble in Benzene,Acetone Sensitivity Moisture sensitive. Freezing Point(°C) 19 °C Refractive Index 1.535 Flash Point(°F) 179.6 °F Flash Point(°C) 82 °C Boil Point(°C) 202°C Melt Point(°C) 20.5°C Molecular Weight 120.150 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 1 Exact Mass 120.058 Da Monoisotopic Mass 120.058 Da Topological Polar Surface Area 17.100 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 101.000 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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