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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 5-Methyl-2-octanone - ≥80%(GC) , CAS No.58654-67-4
Synonyms
5-Methyl-2-octanone | NCGC00356971-01 | Methyl 3-methylhexyl ketone | MFCD00059414 | D91303 | M0278 | CAS-58654-67-4 | EINECS 261-382-4 | Q27294006 | EN300-1866301 | Tox21_303922 | 5-Methyloctan-2-one | 5-PHENYL-PENT-2-EN-4-YNOICACIDMETHYLESTER | BRN 1746
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Why this grade ≥80%(GC) 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 Sinonimi
5-Methyl-2-octanone | NCGC00356971-01 | Methyl 3-methylhexyl ketone | MFCD00059414 | D91303 | M0278 | CAS-58654-67-4 | EINECS 261-382-4 | Q27294006 | EN300-1866301 | Tox21_303922 | 5-Methyloctan-2-one | 5-PHENYL-PENT-2-EN-4-YNOICACIDMETHYLESTER | BRN 1746
Specifiche e purezza
≥80%(GC)
Condizioni di conservazione di stoccaggio
Room temperature
Nomi e identificatori Sorrisi canonici CCCC(C)CCC(=O)C IUPAC Name 5-methyloctan-2-one InChIKey UPVLGOPSYZTLGB-UHFFFAOYSA-N INCHI 1S/C9H18O/c1-4-5-8(2)6-7-9(3)10/h8H,4-7H2,1-3H3 Isomeri SMILES CCCC(C)CCC(=O)C RTECS RH1535000 Numero UN 1224 Gruppo di imballaggio III Peso molecolare 142.24 Reaxy-Rn 1746333 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1746333&ln=
Documentazione 📋 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 Classe Organooxygen compounds Subclass Carbonyl compounds Intermediate Tree Nodes Not available Direct Parent Ketones Alternative Parents Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound Descrizione This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol. 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.
Struttura 3D Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Indice di rifrazione 1.42 Punto di infiammabilità (°C) 58 °C Punto di ebollizione (°C) 102°C/50mmHg(lit.) Peso molecolare 142.240 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 5 Exact Mass 142.136 Da Monoisotopic Mass 142.136 Da Topological Polar Surface Area 17.100 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 96.900 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 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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