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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-Acetyl-2,4-dimethylpyrrole - ≥98% , CAS No.2386-25-6
Synonyms
2,4-Dimethyl-3-acetylpyrrole | 2,4-Dimethyl-3-acetyl-pyrrole | KETONE, 2,5-DIMETHYLPYRROL-3-YL METHYL | 1-(2,4-dimethyl-1H-pyrrol-3-yl)ethanone | 1-(2,4-Dimethyl-1H-pyrrol-3-yl)-ethanone | AI3-60327 | 2,4-dimethyl-3acetyl pyrrole | 2,4-dimethyl-3-acetyl p
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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 Synonyms
2, 4-Dimethyl-3-acetylpyrrole | 2, 4-Dimethyl-3-acetyl-pyrrole | KETONE, 2, 5-DIMETHYLPYRROL-3-YL METHYL | 1-(2, 4-dimethyl-1H-pyrrol-3-yl)ethanone | 1-(2, 4-Dimethyl-1H-pyrrol-3-yl)-ethanone | AI3-60327 | 2, 4-dimethyl-3acetyl pyrrole | 2, 4-dimethyl-3-acetyl p
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 488182076 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488182076 Canonical Smiles CC1=CNC(=C1C(=O)C)C IUPAC Name 1-(2,4-dimethyl-1H-pyrrol-3-yl)ethanone InChIKey VGZCKCJMYREIKA-UHFFFAOYSA-N INCHI 1S/C8H11NO/c1-5-4-9-6(2)8(5)7(3)10/h4,9H,1-3H3 Isomeric SMILES CC1=CNC(=C1C(=O)C)C WGK Germany 3 RTECS OB2885000 Molecular Weight 137.18 Reaxy-Rn 109769 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109769&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 Direct Parent Aryl alkyl ketones Alternative Parents Substituted pyrroles Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Aryl alkyl ketone - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Pyrrole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl 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 Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in Methanol Boil Point(°C) 173°C/12mmHg Melt Point(°C) 136-140℃ Molecular Weight 137.180 g/mol XLogP3 1.200 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 1 Exact Mass 137.084 Da Monoisotopic Mass 137.084 Da Topological Polar Surface Area 32.900 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 144.000 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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