2-Methoxyethyl Chloroformate - ≥93% , CAS No.628-12-6

CAS: 628-12-6 Cat. No.: M158778 Peso molecular: 138.55 Número EC: 211-026-9

GRADE & PURITY ≥93%

Synonyms

2-methoxyethylchloroformate | Chloro(2-methoxyethoxy)methanone | 2-methoxyethyl carbonochloridate | SCHEMBL163984 | D89328 | AKOS015894283 | chlorocarbonic acid 2-methoxy-ethyl ester | chloroformic acid (2-methoxy-ethyl) ester | DTXSID90211880 | MFCD00058

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

Reactant for:Preparation of N-bridged bicyclic sulfonamides as inhibitors of γ-secretase，Preparation of dimethoxyethyl azodicarboxylate via amidation/oxidation and application to Mitsunobu reaction，Regioselective, stereoselective, and kinetically-controlled nickel-catalyzed cyanoesterification of allenes chloroformates and TMSCN，Preparation of amino carboxamidobenzothiazoles as Lck inhibitors，Preparation of nonracemic spirooxindoles using a stereoselective three-component coupling reaction as the key step and using acylation reactions to add structural diversity.

Specifications

Sinónimos

2-methoxyethylchloroformate | Chloro(2-methoxyethoxy)methanone | 2-methoxyethyl carbonochloridate | SCHEMBL163984 | D89328 | AKOS015894283 | chlorocarbonic acid 2-methoxy-ethyl ester | chloroformic acid (2-methoxy-ethyl) ester | DTXSID90211880 | MFCD00058

Especificaciones y pureza

≥93%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥93%

Nombres e identificadores

• Pubchem Sid: 488184315
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184315
• Sonrisas canónicas: COCCOC(=O)Cl
• IUPAC Name: 2-methoxyethyl carbonochloridate
• InChIKey: NDYYWMXJZWHRLZ-UHFFFAOYSA-N
• INCHI: 1S/C4H7ClO3/c1-7-2-3-8-4(5)6/h2-3H2,1H3
• Isómeros SMILES: COCCOC(=O)Cl
• Peso molecular: 138.55
• Reaxy-Rn: 1749802
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1749802&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Organic carbonic acids and derivatives

• 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: Dialkyl ethers Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carbonic acid derivative - Ether - Dialkyl ether - 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.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: Moisture & heat Sensitive.
• Índice de refracción: 1.42
• Punto de inflamación (°F): 138°F)
• Punto de inflamación (°C): 59℃
• Punto de ebullición (°C): 157-158℃
• Peso molecular: 138.550 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 138.008 Da
• Monoisotopic Mass: 138.008 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 73.700
• 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