Propanedioic acid,2-octyl-, 1,3-diethyl ester

Base Information

• Chemical Name: Propanedioic acid,2-octyl-, 1,3-diethyl ester
• CAS No.: 1472-85-1
• Molecular Formula: C15H28 O4
• Molecular Weight: 272.385
• Hs Code.: 2917190090
• Mol file: 1472-85-1.mol

Synonyms:Malonicacid, octyl-, diethyl ester (6CI,7CI,8CI); Propanedioic acid, octyl-, diethylester (9CI); Diethyl 2-octylmalonate; Diethyl n-octylmalonate; Diethyloctylmalonate; NSC 74080

Chemical Property of Propanedioic acid,2-octyl-, 1,3-diethyl ester

Chemical Property:

• Vapor Pressure: 0.000884mmHg at 25°C
• Boiling Point: 304.3°C at 760 mmHg
• Flash Point: 134.7°C
• PSA: 52.60000
• Density: 0.96g/cm³
• LogP: 3.47940

Purity/Quality:

99% ^*data from raw suppliers

DIETHYL OCTYLMALONATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Propanedioic acid,2-octyl-, 1,3-diethyl ester

There total 16 articles about Propanedioic acid,2-octyl-, 1,3-diethyl ester 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: 96.0%

Diethyl-2,7-octadienyl-malonat (29330-87-8) → diethyl octylmalonate (1472-85-1)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol;

DOI:10.1016/S0040-4039(01)83944-7

Reference yield: 93.0%

1-Iodooctane (629-27-6) + diethyl malonate (105-53-3) → diethyl octylmalonate (1472-85-1)

Guidance literature:

diethyl malonate; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; for 0.25h; Inert atmosphere;

1-Iodooctane; In N,N-dimethyl-formamide; mineral oil; at 0 - 25 ℃; for 2h; Solvent; Inert atmosphere;

DOI:10.3762/bjoc.17.135

Reference yield: 90.0%

1-bromo-octane (111-83-1) + diethyl malonate (105-53-3) → diethyl octylmalonate (1472-85-1)

Guidance literature:

With sodium ethanolate; In ethanol; Heating;

DOI:10.1016/j.bmcl.2005.08.055

upstream raw materials:

decanoic acid ethyl ester

oxalic acid diethyl ester

1-Iodooctane

diethyl malonate

Downstream raw materials:

5-octylbarbituric acid

2-(4-bromophenyl)-5-octyl-1,3-dioxane

2-(4-Ethoxy-phenyl)-5-octyl-[1,3]dioxane

2-(4-Ethoxy-phenyl)-5-octyl-[1,3]dioxane

Refernces

• 1、 Cho, Kyung Ho,Du, Yang,Scull, Nicola J.,Hariharan, Parameswaran,Gotfryd, Kamil,Loland, Claus J.,Guan, Lan,Byrne, Bernadette,Kobilka, Brian K.,Chae, Pil Seok. "Novel Xylene-Linked Maltoside Amphiphiles (XMAs) for Membrane Protein Stabilisation". . p. 10008 - 10013. Retrieved 2015.
• 2、 Li, Wei,Varenikov, Andrii,Gandelman, Mark. "Direct Copper-Catalyzed C-H Monofluoroalkylation of Benzoxazoles with 1-Fluoro-1-haloalkanes". supporting information. p. 3138 - 3141. Retrieved 2020/03/13.
• 3、 -. "NOVEL XYLENE-BASED AMPHIPHILIC COMPOUND AND USE THEREOF". Paragraph 0167; 0168; 0178; 0179; 0188. . Retrieved 2018/10/19.