1-Ethyl-1-methylcyclopentane

Base Information

• Chemical Name: 1-Ethyl-1-methylcyclopentane
• CAS No.: 16747-50-5
• Molecular Formula: C8H16
• Molecular Weight: 112.215
• European Community (EC) Number: 689-392-8
• DSSTox Substance ID: DTXSID80168293
• Nikkaji Number: J44.135J
• Wikidata: Q83037855
• Mol file: 16747-50-5.mol

Synonyms:1-ETHYL-1-METHYLCYCLOPENTANE;16747-50-5;Cyclopentane, 1-ethyl-1-methyl-;Cyclopentane, 1-ethyl-1- methyl-;11 -Methyl-1 -ethylcyclopentane;1-ethyl-1-methyl-cyclopentane;methylethylcyclopentane;1-Methyl-1-ethylcyclopentane;1-ethyl-1-methyl cyclopentane;DTXSID80168293;LETYIFNDQBJGPJ-UHFFFAOYSA-N;AKOS006271788;CS-0250550;FT-0637423;EN300-5131476

Chemical Property of 1-Ethyl-1-methylcyclopentane

Chemical Property:

• Vapor Pressure: 19.6mmHg at 25°C
• Melting Point: -112.84°C (estimate)
• Refractive Index: 1.4248
• Boiling Point: 118.8°Cat760mmHg
• Flash Point: 10.6°C
• Density: 0.775g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 112.125200510
• Heavy Atom Count: 8
• Complexity: 68.1

Purity/Quality:

98% Min ^*data from raw suppliers

1-Ethyl-1-methylcyclopentane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(CCCC1)C

Technology Process of 1-Ethyl-1-methylcyclopentane

There total 12 articles about 1-Ethyl-1-methylcyclopentane 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:

1-Methylenspiro<2.4>hept-4-en → 1-ethyl-1-methyl-cyclopentane (16747-50-5) + isopropylcyclopentane (3875-51-2) + n-propylcyclopentane (2040-96-2)

Guidance literature:

With hydrogen; palladium on activated charcoal; In 2,2,4-trimethylpentane; at 25 ℃; Thermodynamic data; heat of hydrogenation;

Reference yield:

ethene (74-85-1) → methyl-cyclopentane (96-37-7) + 1-ethyl-1-methyl-cyclopentane (16747-50-5) + ethyl-cyclohexane (1678-91-7) + n-propylcyclopentane (2040-96-2) + n-pentylcyclopentane (3741-00-2) + methylbutylcyclopentane

Guidance literature:

With carbon monoxide; ytterbium(III) chloride; ethylaluminum dichloride; In n-heptane; at 120 ℃; Product distribution; various AlEtCl₂/YbCl₃ ratio, other catalysts;

DOI:10.1039/c39890001923

Reference yield:

hydrogenchloride (7647-01-0,15364-23-5) + ethyl-cyclohexane (1678-91-7) → 1,1,2-trimethylcyclopentane (4259-00-1) + 1-ethyl-1-methyl-cyclopentane (16747-50-5) + (1R,2S,4S)-1,2,4-Trimethyl-cyclopentane (4850-28-6)

Guidance literature:

at 130 - 250 ℃; Isomerisierung;

upstream raw materials:

methyl magnesium iodide

dibutyl ether

1-Chlor-1-ethylcyclopentan

1-chloro-1-methylcyclopentane

Downstream raw materials:

3-ethyl-3-methyl-pentane

3,3-dimethylhexane

3-methylheptane

ethylbenzene

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