2-(Diethoxymethyl)-1,1-diethoxybutane

Base Information

• Chemical Name: 2-(Diethoxymethyl)-1,1-diethoxybutane
• CAS No.: 30989-69-6
• Molecular Formula: C13H28O4
• Molecular Weight: 248.363
• Hs Code.: 2911000000
• European Community (EC) Number: 695-174-3
• DSSTox Substance ID: DTXSID50496555
• Nikkaji Number: J2.511.356J
• Wikidata: Q82345509
• Mol file: 30989-69-6.mol

Synonyms:30989-69-6;2-(diethoxymethyl)-1,1-diethoxybutane;2-DIETHOXYMETHYL-1,1-DIETHOXYBUTANE;Butane, 2-(diethoxymethyl)-1,1-diethoxy-;DTXSID50496555;MFCD07777091;AKOS030230550

Chemical Property of 2-(Diethoxymethyl)-1,1-diethoxybutane

Chemical Property:

• PSA: 36.92000
• LogP: 2.81080
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 248.19875937
• Heavy Atom Count: 17
• Complexity: 136

Purity/Quality:

99% ^*data from raw suppliers

2-DIETHOXYMETHYL-1,1-DIETHOXYBUTANE 98.00% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C(OCC)OCC)C(OCC)OCC

Technology Process of 2-(Diethoxymethyl)-1,1-diethoxybutane

There total 5 articles about 2-(Diethoxymethyl)-1,1-diethoxybutane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 52.0%

but-1-enyl acetate (5238-40-4) + orthoformic acid triethyl ester (122-51-0) → 2-(diethoxymethyl)-1,1-diethoxybutane (30989-69-6)

Guidance literature:

With iron(III) chloride; sodium hydrogencarbonate; 1) 2 h, reflux; 2) 20 deg C, 2 h;

DOI:10.1007/BF00761992

Reference yield:

1-ethoxybut-1-ene (929-05-5) + orthoformic acid triethyl ester (122-51-0) → 2-(diethoxymethyl)-1,1-diethoxybutane (30989-69-6)

Guidance literature:

With boron fluoride ether;

Reference yield:

(E)-1-ethoxybut-1-ene (1528-20-7) + orthoformic acid triethyl ester (122-51-0) → 2-(diethoxymethyl)-1,1-diethoxybutane (30989-69-6)

Guidance literature:

With zinc(II) chloride; In diethyl ether;

DOI:10.1007/BF00912056

upstream raw materials:

1-ethoxybut-1-ene

orthoformic acid triethyl ester

(E)-1-ethoxybut-1-ene

but-1-enyl acetate

Downstream raw materials:

2-ethyl-3-anilino-acrylaldehyde phenylimine

3-Amino-2-ethyl-acrolein

2-[1-((1S,2R,5S)-2-Isopropyl-5-methyl-cyclohexyl)-meth-(E)-ylidene]-butyraldehyde

(E)-2-ethyl-4-phenylbut-2-enal