N-HEXYL METHYL ETHER

Base Information

• Chemical Name: N-HEXYL METHYL ETHER
• CAS No.: 4747-07-3
• Molecular Formula: C7H16O
• Molecular Weight: 116.203
• Hs Code.: 29091990
• European Community (EC) Number: 225-263-0
• UNII: R99K6ANQ7T
• DSSTox Substance ID: DTXSID3063594
• Nikkaji Number: J121.677E
• Wikidata: Q3333699
• Metabolomics Workbench ID: 45497
• Mol file: 4747-07-3.mol

Synonyms:Hexane, 1-methoxy-;N-HEXYL METHYL ETHER;1-methoxyhexane;

Chemical Property of N-HEXYL METHYL ETHER

Chemical Property:

• Vapor Pressure: 14.5mmHg at 25°C
• Melting Point: -95.35°C (estimate)
• Refractive Index: 1.3950 to 1.3980
• Boiling Point: 125.9°Cat760mmHg
• Flash Point: 21°C
• PSA: 9.23000
• Density: 0.772g/cm³
• LogP: 2.21310
• Solubility.: Soluble in ethanol fixed oils, propylene glycol. Slightly solubl
• Water Solubility.: 660.9mg/L at 24℃
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 116.120115130
• Heavy Atom Count: 8
• Complexity: 35.4

Purity/Quality:

99.9% ^*data from raw suppliers

Hexyl Methyl Ether >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 10-22
• Safety Statements: 7-33-60

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCOC

Technology Process of N-HEXYL METHYL ETHER

There total 19 articles about N-HEXYL METHYL ETHER 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: 95.0%

dimethyl sulfate (77-78-1) + hexan-1-ol (111-27-3) → hexyl methyl ether (4747-07-3)

Guidance literature:

With potassium hydroxide; In 1,4-dioxane; for 1.5h;

DOI:10.1055/s-1986-31729

Reference yield: 94.0%

carbonic acid dimethyl ester (616-38-6) + hexan-1-ol (111-27-3) → hexyl methyl ether (4747-07-3) + 1-hexyl methyl carbonate (39511-75-6)

Guidance literature:

With dicobalt octacarbonyl; at 200 ℃; for 8h; Temperature; Concentration; Activation energy; Mechanism; Autoclave; Green chemistry;

DOI:10.1134/S003602441703013X

Reference yield:

3-chloro-1-methoxy-hex-2-en-4-yne (18668-77-4) → hexyl methyl ether (4747-07-3)

Guidance literature:

With hydrogen; Lindlar's catalyst; In methanol;

upstream raw materials:

1,5-dibromo-pentane

chloromethyl methyl ether

sodium hexanolate

methyl iodide

Downstream raw materials:

6-methoxy-2-hexanone

1-Chlorohexane

benzeneacetic acid methyl ester

1-hexyl acetate