Dihexyl maleate

Base Information

• Chemical Name: Dihexyl maleate
• CAS No.: 16064-83-8
• Deprecated CAS: 197166-94-2
• Molecular Formula: C16H28O4
• Molecular Weight: 284.396
• European Community (EC) Number: 240-208-0
• UNII: 644078XM7J
• ChEMBL ID: CHEMBL3247953
• DSSTox Substance ID: DTXSID201016721
• Nikkaji Number: J114.861C
• Mol file: 16064-83-8.mol

Synonyms:Dihexyl maleate;Di-n-hexyl maleate;Bis(1-hexyl) maleate;16064-83-8;2-Butenedioic acid (2Z)-, 1,4-dihexyl ester;644078XM7J;2-Butenedioic acid (2Z)-, dihexyl ester;dihexyl (Z)-but-2-enedioate;EINECS 240-208-0;AI3-00997;SCHEMBL573258;dihexyl (2Z)-but-2-enedioate;CHEMBL3247953;UNII-644078XM7J;DTXSID201016721;MALEIC ACID, DIHEXYL ESTER;2-Butenedioic acid, (Z)-, dihexyl ester;2-Butenedioic acid, dihexyl ester, (2Z)-;NS00012227;W-110424

Chemical Property of Dihexyl maleate

Chemical Property:

• Vapor Pressure: 2.43E-05mmHg at 25°C
• Boiling Point: 359.1°C at 760 mmHg
• Flash Point: 167.4°C
• Density: 0.969g/cm³
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 14
• Exact Mass: 284.19875937
• Heavy Atom Count: 20
• Complexity: 256

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCOC(=O)C=CC(=O)OCCCCCC
• Isomeric SMILES: CCCCCCOC(=O)/C=C\C(=O)OCCCCCC

Technology Process of Dihexyl maleate

There total 3 articles about Dihexyl maleate 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: 80.0%

maleic anhydride (108-31-6) + hexan-1-ol (111-27-3) → maleic acid dihexyl ester (16064-83-8)

Guidance literature:

With toluene-4-sulfonic acid; at 124.85 ℃; for 2h;

DOI:10.1021/je060152v

Reference yield:

maleic acid (110-16-7,26099-09-2) + hexan-1-ol (111-27-3) → maleic acid dihexyl ester (16064-83-8)

Guidance literature:

With sulfuric acid; benzene; beim Entfernen des gebildeten Wassers;

DOI:10.1021/ja01112a526

Reference yield:

→ maleic acid dihexyl ester (16064-83-8)

Guidance literature:

Maleinsaeureanhydrid, A., Bzl., p-Toluolsulfonsaeure;

upstream raw materials:

maleic acid

hexan-1-ol

maleic anhydride

Downstream raw materials:

sodium 1,4-dihexyl sulfosuccinate

Refernces

• 1、 Liu, Zhao-Tie,Liu, Ling,Wu, Jin,Song, Liping,Gao, Ziwei,Dong, Wensheng,Lu, Jian. "Solubility and phase behaviors of AOT analogue surfactants in 1,1,1,2-tetrafluoroethane and supercritical carbon dioxide". . p. 2045 - 2050. Retrieved 2007/10/03.
• 2、 Nagasoe, Yasuyuki,Ichiyanagi, Naoki,Okabayashi, Hirofumi,Nave, Sandrine,Eastoe, Julian,O'Connor, Charmian J.. "Raman and IR spectroscopic studies of the interaction between counterion and polar group in self-assembled systems of AOT-homologous 'sodium dialkyl sulfosuccinates'". . p. 4395 - 4407. Retrieved 2007/10/03.