2-Ethoxyacetyl chloride - ≥97% , CAS No.14077-58-8

CAS: 14077-58-8 Cat. No.: E293992 Summenformel: C₄H₇ClO₂ Molekulargewicht: 122.55 EG-Nummer: 237-930-3

GRADE & PURITY ≥97%

Synonyms

2-ethoxyacetyl chloride|Ethoxyacetyl chloride|14077-58-8|Acetyl chloride, 2-ethoxy-|ethoxy-acetyl chloride|Ethoxyacetylchloride|2-Ethoxyacetylchloride|EINECS 237-930-3|Ethoxy acetyl chloride|ethoxyacetic acid chloride|(2-Ethoxy)-acetyl chloride|SCHEMBL316

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Übersicht

It is employed in fine chemical syntheses and used as pharmaceutical intermediates. A trace of cis-ethoxyacetamide was also detected and isolated with an authentic sample prepared from the reaction of cis-3-amino-6-methylchroman-4-01 (2) with 2-ethoxyacetyl chloride.

Specifications

Synonyme

2-ethoxyacetyl chloride | Ethoxyacetyl chloride | 14077-58-8 | Acetyl chloride, 2-ethoxy- | ethoxy-acetyl chloride | Ethoxyacetylchloride | 2-Ethoxyacetylchloride | EINECS 237-930-3 | Ethoxy acetyl chloride | ethoxyacetic acid chloride | (2-Ethoxy)-acetyl chloride | SCHEMBL316

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

• Pubchem Sid: 508808023
• Kanonisches Lächeln: CCOCC(=O)Cl
• IUPAC Name: 2-ethoxyacetyl chloride
• InChIKey: ZPMWWAIBJJFPPQ-UHFFFAOYSA-N
• INCHI: 1S/C4H7ClO2/c1-2-7-3-4(5)6/h2-3H2,1H3
• Isomere SMILES: CCOCC(=O)Cl
• Molekulargewicht: 122.55
• Reaxy-Rn: 1742995
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1742995&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Klasse Acyl halides
      • Subclass Acyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Klasse: Acyl halides
• Subclass: Acyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl chlorides
• Alternative Parents: Dialkyl ethers Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ether - Dialkyl ether - Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as acyl chlorides. These are organic compounds containing the functional group -CO-Cl.
• 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.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Löslichkeit: Insoluble in water.
• Empfindlichkeit: heat sensitive
• Molekulargewicht: 122.550 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 122.013 Da
• Monoisotopic Mass: 122.013 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 62.700
• 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