1,2-Bis(2-chloroethoxy)ethane - ≥98%(GC) , CAS No.112-26-5

CAS: 112-26-5 Cat. No.: B152851 Fórmula: C₆H₁₂Cl₂O₂ Peso molecular: 187.06 Beilstein Registry Number: 506177 Número EC: 203-952-7

CALIDAD & PUREZA ≥98%(GC)

Synonyms

28JQ82M13J | AKOS009031431 | Ethylene Glycol Bis(2-chloroethyl) Ether | UNII-28JQ82M13J | EN300-19706 | FT-0606294 | 2-(2-Chloroethoxy)ethyl 2'-chloroethyl ether | Triethylene glycol dichloride | Bis(chloroethoxy)ethane | NCGC00256237-01 | Bis(2-chloroeth

Storage

Room temperature

Shipped In

Normal

Descripción general

Usually used in the synthesis of 1,1′-[1,2-ethanediylbis(oxy-1,2-ethanediyl)]bis[3-methyl-1H-imidazolium-1-yl] chloride.

Especificaciones

Sinónimos

28JQ82M13J | AKOS009031431 | Ethylene Glycol Bis(2-chloroethyl) Ether | UNII-28JQ82M13J | EN300-19706 | FT-0606294 | 2-(2-Chloroethoxy)ethyl 2'-chloroethyl ether | Triethylene glycol dichloride | Bis(chloroethoxy)ethane | NCGC00256237-01 | Bis(2-chloroeth

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

Pubchem Sid

488180713

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180713

Sonrisas canónicas

C(COCCCl)OCCCl

IUPAC Name

1,2-bis(2-chloroethoxy)ethane

InChIKey

AGYUOJIYYGGHKV-UHFFFAOYSA-N

INCHI

1S/C6H12Cl2O2/c7-1-3-9-5-6-10-4-2-8/h1-6H2

Isómeros SMILES

C(COCCCl)OCCCl

WGK Alemania

3

RTECS

KH4900000

Número ONU

2810

Grupo de embalaje

III

Peso molecular

187.06

Beilstein

506177

Reaxy-Rn

506177

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506177&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• 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

• Solubilidad: Insoluble in water.
• Índice de refracción: 1.46
• Punto de inflamación (°F): 249.8 °F
• Punto de inflamación (°C): 121 °C
• Punto de ebullición (°C): 235°C
• Punto de fusión (°C): -32°C
• Peso molecular: 187.060 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 186.021 Da
• Monoisotopic Mass: 186.021 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 53.700
• 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

Preguntas frecuentes

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 112-26-5, the molecular formula is C6H12Cl2O2, and the molecular weight is 187.06 g/mol. InChIKey AGYUOJIYYGGHKV-UHFFFAOYSA-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.