Dipentyl succinate

Base Information

• Chemical Name: Dipentyl succinate
• CAS No.: 645-69-2
• Molecular Formula: C14H26O4
• Molecular Weight: 258.358
• Hs Code.: 2917190090
• European Community (EC) Number: 211-452-5
• NSC Number: 1501
• UNII: 2E33CP3MKW
• DSSTox Substance ID: DTXSID30214754
• Nikkaji Number: J95.559K
• Wikidata: Q72472974
• Mol file: 645-69-2.mol

Synonyms:Dipentyl succinate;645-69-2;dipentyl butanedioate;Diamyl succinate;Butanedioic acid, dipentyl ester;Succinic acid, dipentyl ester;AI3-03426;NSC-1501;EINECS 211-452-5;Butanedioic acid dipentyl ester;Bernsteinsaure-n-amylester;Succinic acid diamyl ester;2E33CP3MKW;SCHEMBL19556;Di-n-pentyl succinate, 95%;Butanedioic acid, dipenyl ester;DTXSID30214754;NSC1501;NSC 1501;SUCCINIC ACID DIPENTYL ESTER;AKOS024333529;Butanedioic acid, 1,4-dipentyl ester;FT-0724601;E79254;J-520379

Chemical Property of Dipentyl succinate

Chemical Property:

• Vapor Pressure: 0.00109mmHg at 25°C
• Melting Point: -10.8°C
• Refractive Index: 1.441
• Boiling Point: 300.9 °C at 760 mmHg
• Flash Point: 135 °C
• PSA: 52.60000
• Density: 0.969 g/cm³
• LogP: 3.23340
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 13
• Exact Mass: 258.18310931
• Heavy Atom Count: 18
• Complexity: 202

Purity/Quality:

99% ^*data from raw suppliers

DIPENTYL SUCCINATE AldrichCPR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCOC(=O)CCC(=O)OCCCCC

Technology Process of Dipentyl succinate

There total 3 articles about Dipentyl succinate 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: 69.0%

pentan-1-ol (71-41-0) + succinic acid (110-15-6) → butanedioic acid dipentyl ester (645-69-2)

Guidance literature:

With 6H₂O*Na₃[AlMo₆O₁₈(OH)6]; at 120 ℃; Green chemistry;

DOI:10.1007/s11164-021-04570-z

Reference yield:

pentan-1-ol (71-41-0) + succinoyl dichloride (543-20-4) → butanedioic acid dipentyl ester (645-69-2)

Guidance literature:

With potassium hydroxide; air; ethanol; potassium tetracarbonylhydridoferrate; Yield given. Multistep reaction; 1.) room temp., 6 h, 2.) 48 h;

DOI:10.1055/s-1987-27844

Reference yield:

n-pentyl 2-chloroacetate (5411-55-2) + methoxybenzene (100-66-3) → butanedioic acid dipentyl ester (645-69-2) + pentyl 2-(4-methoxyphenyl)acetate + (3-Methoxy-phenyl)-acetic acid pentyl ester + (2-Methoxy-phenyl)-acetic acid pentyl ester

Guidance literature:

In ethyl acetate; for 24h; Product distribution; Irradiation; effect of β-cyclodextrin investigated;

DOI:10.1016/S0040-4039(00)77042-0

upstream raw materials:

pentan-1-ol

succinic acid

n-pentyl 2-chloroacetate

methoxybenzene

Refernces

• 1、 Lu, Deli,Xu, Yumeng,Chen, Zhe,Han, Sheng. "Biomass-derived dibasic acids to diesters with inorganic ligand-supported catalyst: synthesis, optimization, characterization". . p. 321 - 337. Retrieved 2021/08/23.