Ethyl 2-Chloro-2-(hydroxyimino)acetate - ≥98% , CAS No.14337-43-0

CAS: 14337-43-0 Cat. No.: E156474 Molecular Weight: 151.55 Beilstein Registry Number: 606193 EC Number: 604-347-4 PubChem CID: 9576005

GRADE & PURITY ≥98%

Synonyms

Chloroacetic acid, 2-oxime, ethyl ester | Ethyl (2Z)-chloro(hydroxyimino)ethanoate # | ethyl (2Z)-2-chloro-2-(hydroxyimino)acetate | ethyl chlorooximido acetate | ethyl (2E)-chloro(hydroxyimino)acetate | ethyl (E)-2-chloro-2-(hydroxyimino)acetate | Ethyl

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

Chloroacetic acid, 2-oxime, ethyl ester | Ethyl (2Z)-chloro(hydroxyimino)ethanoate # | ethyl (2Z)-2-chloro-2-(hydroxyimino)acetate | ethyl chlorooximido acetate | ethyl (2E)-chloro(hydroxyimino)acetate | ethyl (E)-2-chloro-2-(hydroxyimino)acetate | Ethyl

Specifications & Purity

≥98%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504764830
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764830
• IUPAC Name: ethyl (2Z)-2-chloro-2-hydroxyiminoacetate
• InChIKey: UXOLDCOJRAMLTQ-UTCJRWHESA-N
• INCHI: 1S/C4H6ClNO3/c1-2-9-4(7)3(5)6-8/h8H,2H2,1H3/b6-3-
• Isomeric SMILES: CCOC(=O)/C(=N/O)/Cl
• WGK Germany: 3
• PubChem CID: 9576005
• Molecular Weight: 151.55
• Beilstein: 606193
• Reaxy-Rn: 606193

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Alpha-halocarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Alpha-halocarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Alpha-halocarboxylic acid derivatives
• Alternative Parents: Carboxylic acid esters Monocarboxylic acids and derivatives Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-halocarboxylic acid derivative - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha-halocarboxylic acid derivatives. These are carboxylic acid derivatives containing a halogen atom bonded to the alpha carbon atom.
• 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

Chemical and Physical Properties

• Solubility: Soluble in Methanol
• Sensitivity: Moisture sensitive.
• Melt Point(°C): 70-83℃
• Molecular Weight: 151.550 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 151.004 Da
• Monoisotopic Mass: 151.004 Da
• Topological Polar Surface Area: 58.900 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 134.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1