diethylhexanoic acid

Base Information

• Chemical Name: diethylhexanoic acid
• CAS No.: 4528-37-4
• Molecular Formula: C₁₀H₂₀O₂
• Molecular Weight: 172.268
• Hs Code.: 2915900090
• Mol file: 4528-37-4.mol

Synonyms:Caproicacid, a,a-diethyl- (4CI); 2,2-Diethylhexanoic acid; NSC 467; a,a-Diethylcaproic acid

Chemical Property of diethylhexanoic acid

Chemical Property:

• Vapor Pressure: 0.00263mmHg at 25°C
• Boiling Point: 265.6°Cat760mmHg
• Flash Point: 121.3°C
• PSA: 37.30000
• Density: 0.914g/cm³
• LogP: 3.06760
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Methanol (Slightly)

Purity/Quality:

98% ^*data from raw suppliers

2,2-DiethylhexanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 2,2-Diethylhexanoic Acid is a pollutant that is found in anaerobic environment of river sediments,

Technology Process of diethylhexanoic acid

There total 9 articles about diethylhexanoic acid 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: 81.0%

1-bromo-butane (109-65-9) + 2-Ethylbutanoic acid (88-09-5) → 2,2-Diethylhexansaeure (4528-37-4)

Guidance literature:

Reference yield:

2,2-diethyl-hexanoic acid-(1,1-diethyl-propyl ester) (108062-91-5) → 2,2-Diethylhexansaeure (4528-37-4)

Guidance literature:

With 1,4-dioxane; hydrogenchloride;

DOI:10.1021/ja01596a076

Reference yield:

chlorure d'acide ethyl-2 butyrique (2736-40-5) → 2,2-Diethylhexansaeure (4528-37-4)

Guidance literature:

Multi-step reaction with 3 steps

1: diethyl ether

2: diethyl ether; potassium amide; liquid ammonia / und anschliessend mit Butylbromid

3: concentrated aqueous hydrochloric acid; dioxane

With 1,4-dioxane; hydrogenchloride; diethyl ether; ammonia; potassium amide;

DOI:10.1021/ja01596a076

upstream raw materials:

2,2-diethyl-hexanoic acid-(1,1-diethyl-propyl ester)

2,2-diethyl-hexanoic acid amide

1-bromo-butane

2-Ethylbutanoic acid

Refernces

• 1、 Weiske, Thomas,Schwarz, Helmut. "Pseudo One-Step Cleavage of C-C Bonds in the Decomposition of Ionized Carboxyclic Acids. Radical Like Reactions in Mass Spectrometry". . p. 323 - 347. Retrieved 2007/10/02.