Diethoxy methane - anhydrous, ≥99%, stabilized with 100 ppm BHT , CAS No.462-95-3

CAS: 462-95-3 Cat. No.: D139939 Fórmula: C₅H₁₂O₂ Peso molecular: 104.15 Beilstein Registry Number: 1697253 Número CE: 207-330-6

GRAU & PUREZA Anhydrous Grade, ≥99%, stabilized with 100 ppm BHT

Synonyms

3,5-Dioxaheptene|ETHYLAL [INCI]|1,1-DIETHOXYMETHANE|1-(Ethoxymethoxy)ethane|3,5-Dioxaheptane|ethoxymethoxy-ethane|Methane, diethoxy-|Ethane, 1,1'-[methylenebis(oxy)]bis-|Ethoxymethyl ethyl ether|Formaldehyde diethyl acetal|formaldehyde diethylacetal|Ethane,1'-[methylenebis(oxy)]bis-|Formaldehyde, diethyl acetal|formaldehyde-diethylacetal|Ethane, 1,1'-(methylenebis(oxy))bis-|Ethylal|Diethoxymethane [UN2373] [Flammable liquid]|Methylene Glycol Diethyl Ether|Diethylformal|(ethoxymethoxy)ethane|Diethoxymethane|1-(Ethoxymethoxy)ethane #|Diethoxy methane

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Visão geral

Description：

Formaldehyde diethyl acetal (FDEA, diethoxymethane, DEM) is a diethyl acetal. It has been synthesized from ethanol and aqueous formaldehyde. It is a low boiling solvent useful for sodium hydride reactions, organolithium chemistry, copper-catalyzed conjugate additions and phase-transfer reactions. It is a potential alternate for tetrahydrofuran, dichloromethane, glyme and methylal. DEM is an ethoxymethylating agent, a formaldehyde equivalent and a carbonylation substrate. Its condensation with 2-propylresorcinol to form resorcin[n]arenes (n=4–7) has been investigated. The IR and Raman spectra and conformations of DEM have been studied. NMR spectroscopy has been used to study the aggregation behavior of organolithium compounds in diethoxymethane. Unimolecular metastable decomposition of DEM upon electron impact has been studied. Solubility of non-polar gases in DEM has been evaluated.

Especificações

Sinónimos

3,5-Dioxaheptene | ETHYLAL [INCI] | 1,1-DIETHOXYMETHANE | 1-(Ethoxymethoxy)ethane | 3,5-Dioxaheptane | ethoxymethoxy-ethane | Methane, diethoxy- | Ethane, 1,1'-[methylenebis(oxy)]bis- | Ethoxymethyl ethyl ether | Formaldehyde diethyl acetal | formaldehyde diethylacetal | Ethane,1'-[methylenebis(oxy)]bis- | Formaldehyde, diethyl acetal | f Show more

Especificações e pureza

anhydrous, ≥99%, stabilized with 100 ppm BHT

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

FedEx DG Service

Grau

Anhydrous Grade

Pureza

≥99%

Nomes e identificadores

Pubchem Sid

504751898

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751898

Sorrisos canónicos

CCOCOCC

IUPAC Name

ethoxymethoxyethane

InChIKey

KLKFAASOGCDTDT-UHFFFAOYSA-N

INCHI

1S/C5H12O2/c1-3-6-5-7-4-2/h3-5H2,1-2H3

SMILES isoméricas

CCOCOCC

WGK Alemanha

2

RTECS

PA8500000

Número UN

2373

Grupo de embalagem

II

Peso molecular

104.15

Beilstein

1697253

Reaxy-Rn

1697253

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697253&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Acetals
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acetal - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as acetals. These are compounds having the structure R2C(OR')2 ( R' not Hydrogen) and thus diethers of geminal diols. Originally, the term was confined to derivatives of aldehydes (one R = H), but it now applies equally to derivatives of ketones (neither R = H ). Mixed acetals have different R' 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

Propriedades químicas e físicas

• Sensibilidade: Moisture sensitive
• Índice de refração: 1.372-1.374
• Ponto de inflamação (°F): 23 °F
• Ponto de inflamação (°C): -5℃
• Ponto de ebulição (°C): 87.5°C
• Ponto de fusão (°C): -66.5°C
• Peso molecular: 104.150 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 104.084 Da
• Monoisotopic Mass: 104.084 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 25.300
• 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