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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Chlorocarbonic acid-(1-ethyl-butyl ester) - ≥85%(NMR) , CAS No.58906-64-2
Synonyms
2-Ethylbutyl carbonochloridate|58906-64-2|2-ethylbutyl chloroformate|Chlorocarbonic acid-(1-ethyl-butyl ester)|Carbonochloridic acid, 2-ethylbutyl ester|2-ethyl-1-butyl chloroformate|9A2UY643ND|SCHEMBL7757259|DTXSID10711155|VUUZCSIOWVZJQB-UHFFFAOYSA-N|GEO
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Why this grade ≥85%(NMR) 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
2-Ethylbutyl carbonochloridate | 58906-64-2 | 2-ethylbutyl chloroformate | Chlorocarbonic acid-(1-ethyl-butyl ester) | Carbonochloridic acid, 2-ethylbutyl ester | 2-ethyl-1-butyl chloroformate | 9A2UY643ND | SCHEMBL7757259 | DTXSID10711155 | VUUZCSIOWVZJQB-UHFFFAOYSA-N | GEO
Especificaciones y pureza
≥85%(NMR)
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas
CCC(CC)COC(=O)Cl
IUPAC Name
2-ethylbutyl carbonochloridate
InChIKey
VUUZCSIOWVZJQB-UHFFFAOYSA-N
INCHI
1S/C7H13ClO2/c1-3-6(4-2)5-10-7(8)9/h6H,3-5H2,1-2H3
Isómeros SMILES
CCC(CC)COC(=O)Cl
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1750736&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 acids and derivatives Clase Organic carbonic acids and derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Organic carbonic acids and derivatives Alternative Parents Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic acyclic compounds Substituents Carbonic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Aliphatic acyclic compound Descripción This compound belongs to the class of organic compounds known as organic carbonic acids and derivatives. These are compounds comprising the organic carbonic acid or a derivative thereof. 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 164.630 g/mol XLogP3 3.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 5 Exact Mass 164.06 Da Monoisotopic Mass 164.06 Da Topological Polar Surface Area 26.300 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 99.800 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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