1-Methoxy-2,2-dimethylpropane

Base Information

• Chemical Name: 1-Methoxy-2,2-dimethylpropane
• CAS No.: 1118-00-9
• Molecular Formula: C6H14 O
• Molecular Weight: 102.177
• Hs Code.: 2909199090
• DSSTox Substance ID: DTXSID30149734
• Nikkaji Number: J125.006J
• Wikidata: Q83015600
• Mol file: 1118-00-9.mol

Synonyms:Ether,methyl neopentyl (7CI,8CI); 1-Methoxy-2,2-dimethylpropane;2,2-Dimethyl-1-methoxypropane; 2,2-Dimethylpropyl methyl ether; Methylneopentyl ether

Chemical Property of 1-Methoxy-2,2-dimethylpropane

Chemical Property:

• Vapor Pressure: 111mmHg at 25°C
• Melting Point: -105.78°C (estimate)
• Refractive Index: 1.3810
• Boiling Point: 76.5°Cat760mmHg
• Flash Point: °C
• PSA: 9.23000
• Density: 0.762g/cm³
• LogP: 1.67890
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 102.104465066
• Heavy Atom Count: 7
• Complexity: 42.6

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)COC

Technology Process of 1-Methoxy-2,2-dimethylpropane

There total 2 articles about 1-Methoxy-2,2-dimethylpropane 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: 35.0%

methanol (67-56-1) + 2,2-dimethyl-1-propyl phenyl selenide (96503-15-0) → tert-Amyl methyl ether (994-05-8) + methyl t-butylmethyl ether (1118-00-9) + diphenyl diselenide (1666-13-3)

Guidance literature:

With naphthalene-1,4-dicarbonitrile; for 8h; Ambient temperature; Irradiation;

DOI:10.1021/jo00103a031

Reference yield:

methanol (67-56-1) + 2,2-dimethyl-1-propyl phenyl selenide (96503-15-0) → tert-Amyl methyl ether (994-05-8) + methyl t-butylmethyl ether (1118-00-9)

Guidance literature:

With naphthalene-1,4-dicarbonitrile; Irradiation;

DOI:10.1021/ja00170a045

Reference yield: 47.0%

methyl t-butylmethyl ether (1118-00-9) + 1,2,4,5-tetracyanobenzene (712-74-3) + but-3-enenitrile (109-75-1) → 2-(2,4,5-Tricyanophenyl)-4,4-dimethylpentanenitrile + 5-(neopentyloxymethyl)benzene-1,2,4-tricarbonitrile + 5-(1-cyano-3-neopentyloxypropyl)benzene-1,2,4-tricarbonitrile + 5-(1-cyano-4,4-dimethyl-3-methoxypentyl)benzene-1,2,4-tricarbonitrile

Guidance literature:

In acetonitrile; for 1h; Further byproducts given; Irradiation;

upstream raw materials:

methanol

2,2-dimethyl-1-propyl phenyl selenide

Downstream raw materials:

5-tert-Butyl-1,2,4-Benzenetricarbonitrile

3-(tert-butoxy)propane-1,2-diol

1,3-di-tert-buthyl glycerol ether

hexadecanoic acid methyl ester

Refernces

• 1、 Pandey, Ganesh,Soma Sekhar,Bhalerao. "Photoinduced single electron transfer initiated heterolytic carbon-selenium bond dissociation. Sequential one-pot selenenylation and deselenenylation reaction". . p. 5650 - 5651. Retrieved 2007/10/02.