Formaldehyde diisopropyl acetal

Base Information

• Chemical Name: Formaldehyde diisopropyl acetal
• CAS No.: 2568-89-0
• Molecular Formula: C7H16 O2
• Molecular Weight: 132.203
• European Community (EC) Number: 607-774-4
• DSSTox Substance ID: DTXSID90880717
• Nikkaji Number: J100.452B
• Wikidata: Q82862083
• Mol file: 2568-89-0.mol

Synonyms:Formaldehyde diisopropyl acetal;2568-89-0;Propane, 2,2'-[methylenebis(oxy)]bis-;Methane, diisopropoxy-;Diisopropoxymethane;2-(propan-2-yloxymethoxy)propane;Isopropylal;Diisopropyl formal;di-i-propoxymethane;diisopropxoy-methane;SCHEMBL818625;2-(Isopropoxymethoxy)propane #;DTXSID90880717;CAA56889;2-[(propan-2-yloxy)methoxy]propane;AS-60451;D93413;A905618

Chemical Property of Formaldehyde diisopropyl acetal

Chemical Property:

• Vapor Pressure: 13.7mmHg at 25°C
• Boiling Point: 127.1°C at 760 mmHg
• Flash Point: 16°C
• PSA: 18.46000
• Density: 0.839g/cm³
• LogP: 1.79390
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 132.115029749
• Heavy Atom Count: 9
• Complexity: 51.9

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OCOC(C)C

Technology Process of Formaldehyde diisopropyl acetal

There total 5 articles about Formaldehyde diisopropyl acetal 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: 5.0%

Dimethoxymethane (109-87-5) + 1,1-diisopropoxy-ethane (4285-59-0) → 1,1-dimethoxyethane (534-15-6) + diisopropoxymethane (2568-89-0) + 2-(1-methoxy-ethoxy)-propane (78400-79-0) + methoxyisopropoxymethane (25186-96-3)

Guidance literature:

With KU-2 resin; at 40 ℃; for 5h;

Reference yield:

carbon dioxide (124-38-9,18923-20-1) + isopropyl alcohol (67-63-0,8013-70-5) → methanol (67-56-1) + diisopropoxymethane (2568-89-0) + isopropyl formate (625-55-8)

Guidance literature:

With cobalt(II) tetrafluoroborate hexahydrate; hydrogen; bis(trifluoromethanesulfonyl)amide; [2-((diphenylphospino)methyl)-2-methyl-1,3-propanediyl]bis[diphenylphosphine]; In tetrahydrofuran; at 80 ℃; for 22h; under 15001.5 - 60006 Torr; Catalytic behavior; Schlenk technique; Autoclave;

DOI:10.1002/anie.201702905

Reference yield:

carbon dioxide (124-38-9,18923-20-1) + isopropyl alcohol (67-63-0,8013-70-5) → diisopropoxymethane (2568-89-0) + isopropyl formate (625-55-8)

Guidance literature:

isopropyl alcohol; With aluminium(III) triflate; [Ru(1,1,1-tris(diphenylphosphinomethyl)ethane)(trimethylene methane)]; for 0.0833333h; Inert atmosphere; Schlenk technique;

carbon dioxide; With hydrogen; at 80 ℃; for 18h; under 60006 Torr; Catalytic behavior; Schlenk technique; Autoclave;

DOI:10.1002/anie.201606427

upstream raw materials:

Dimethoxymethane

1,1-diisopropoxy-ethane

tetrahydrofuran

isopropoxymethyl chloride

Downstream raw materials:

N-isobutyl-N-(isopropoxymethyl)acetamide

2-Chloro-N-(2,6-diethyl-phenyl)-N-isopropoxymethyl-acetamide

17α-Acetoxy-6-methylene-pregn-4-ene-3,20-dione

Isopropyloxymethyl-benzyl-aether

Refernces

• 1、 Thenert, Katharina,Beydoun, Kassem,Wiesenthal, Jan,Leitner, Walter,Klankermayer, Jürgen. "Ruthenium-Catalyzed Synthesis of Dialkoxymethane Ethers Utilizing Carbon Dioxide and Molecular Hydrogen". supporting information. p. 12266 - 12269. Retrieved 2016/10/13.