에틸 2-클로로-2-(하이드록시이미노)아세테이트 - ≥98% , CAS No.14337-43-0

CAS: 14337-43-0 Cat. No.: E156474 분자식: C₄H₆ClNO₃ 분자량: 151.55 Beilstein Registry Number: 606193 EC 번호: 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

2-8°C, 아르곤 충전 상태로 보관

Shipped In

젖은 얼음

Specifications

동의어

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

사양 및 순도

≥98%

보관 조건

2-8°C, 아르곤 충전 상태로 보관

배송

젖은 얼음

순수함

≥98%

이름과 식별자

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-

이성체 SMILES

CCOC(=O)/C(=N/O)/Cl

WGK 독일

3

PubChem CID

9576005

분자량

151.55

Beilstein

606193

Reaxy-Rn

606193

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 분류: 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
• 설명: 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

화학 및 물리적 특성

• 용해성: Soluble in Methanol
• 감도: Moisture sensitive.
• 녹는점(°C): 70-83℃
• 분자량: 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 14337-43-0, the molecular formula is C4H6ClNO3, and the molecular weight is 151.55 g/mol. InChIKey UXOLDCOJRAMLTQ-UTCJRWHESA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.