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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 1,1-Dichloropinacolin - ≥98%(GC) , CAS No.22591-21-5
Synonyms
BRN 1752918 | XAA59121 | SCHEMBL5773491 | DTXSID8027822 | UDWZXMQIEHAAQT-UHFFFAOYSA- | W-107465 | 1,1-Dichloropinacolone | AKOS008996494 | Dichloropinakolin | Q27286911 | CAS-22591-21-5 | UNII-Q287GUL608 | 1,1-Dichloropinacolin | Dichloromethyl tert-butyl
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Why this grade ≥98%(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
BRN 1752918 | XAA59121 | SCHEMBL5773491 | DTXSID8027822 | UDWZXMQIEHAAQT-UHFFFAOYSA- | W-107465 | 1,1-Dichloropinacolone | AKOS008996494 | Dichloropinakolin | Q27286911 | CAS-22591-21-5 | UNII-Q287GUL608 | 1,1-Dichloropinacolin | Dichloromethyl tert-butyl
Specifiche e purezza
≥98%(GC)
Condizioni di conservazione di stoccaggio
Room temperature
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488183176
Sorrisi canonici
CC(C)(C)C(=O)C(Cl)Cl
IUPAC Name
1,1-dichloro-3,3-dimethylbutan-2-one
InChIKey
UDWZXMQIEHAAQT-UHFFFAOYSA-N
INCHI
1S/C6H10Cl2O/c1-6(2,3)4(9)5(7)8/h5H,1-3H3
Isomeri SMILES
CC(C)(C)C(=O)C(Cl)Cl
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1752918&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 Ketones - Alpha-haloketones Direct Parent Alpha-chloroketones Alternative Parents Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides Molecular Framework Aliphatic acyclic compounds Substituents Alpha-chloroketone - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound Descrizione This compound belongs to the class of organic compounds known as alpha-chloroketones. These are organic compounds contaning a chlorine atom attached to the alpha carbon atom relative to C=O 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.
Struttura 3D Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Punto di ebollizione (°C) 178 °C Punto di fusione (°C) 50 °C Peso molecolare 169.050 g/mol XLogP3 2.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 2 Exact Mass 168.011 Da Monoisotopic Mass 168.011 Da Topological Polar Surface Area 17.100 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 113.000 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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