Tris(2-ethylhexyl) borate

Base Information

• Chemical Name: Tris(2-ethylhexyl) borate
• CAS No.: 2467-13-2
• Molecular Formula: C24H51 B O3
• Molecular Weight: 398.478
• Hs Code.: 2920909090
• European Community (EC) Number: 219-581-9
• NSC Number: 97597
• DSSTox Substance ID: DTXSID50947613
• Nikkaji Number: J42.790J
• Mol file: 2467-13-2.mol

Synonyms:Tris(2-ethylhexyl) borate;2467-13-2;Tri(2-ethylhexyl) borate;2-Ethylhexyl borate, tri-;Tris(2-ethylhexyl) orthoborate;EINECS 219-581-9;1-Hexanol, 2-ethyl-, borate;BORIC ACID, TRIS(2-ETHYLHEXYL) ESTER;Boric acid (H3BO3), tris(2-ethylhexyl) ester;NSC 97597;BRN 1712331;4-01-00-01788 (Beilstein Handbook Reference);tris-2-ethylhexyl borate;1-Hexanol, borate;starbld0018150;SCHEMBL186004;TRIS-2-ETHYLHEXYL?BORATE;C24H51BO3;DTXSID50947613;NSC97597;Boric acid tris(2-ethylhexyl) ester;NSC-97597;AKOS024429122;LS-45052;WLN: 4Y2&1OBO1Y4&2&O1Y4&2;4,4,4-TRICHLOROACETOACETICACIDETHYLESTER;Boric acid (H3-BO3), tris(2-ethylhexyl) ester

Chemical Property of Tris(2-ethylhexyl) borate

Chemical Property:

• Vapor Pressure: 4.35E-05mmHg at 25°C
• Boiling Point: 361.3°Cat760mmHg
• Flash Point: 121.8°C
• PSA: 27.69000
• Density: 0.853g/cm³
• LogP: 7.67030
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 21
• Exact Mass: 398.3931257
• Heavy Atom Count: 28
• Complexity: 267

Purity/Quality:

99.9% ^*data from raw suppliers

TRIS(2-ETHYLHEXYL) BORATE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(OCC(CC)CCCC)(OCC(CC)CCCC)OCC(CC)CCCC

Technology Process of Tris(2-ethylhexyl) borate

There total 2 articles about Tris(2-ethylhexyl) borate 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: 85.0%

2-Ethylhexyl alcohol (104-76-7) → B(OCH2CH(C2H5)(n-C4H9))3 (2467-13-2)

Guidance literature:

With boric acid; In toluene; Reflux;

Reference yield:

2-Ethylhexyl alcohol (104-76-7) + boric acid (11113-50-1,14635-83-7) → B(OCH2CH(C2H5)(n-C4H9))3 (2467-13-2)

Guidance literature:

In water; esterification (further medium: organic solvent);

Reference yield:

B(OCH2CH(C2H5)(n-C4H9))3 (2467-13-2) → 2-Ethylhexyl alcohol (104-76-7)

Guidance literature:

upstream raw materials:

2-Ethylhexyl alcohol

boric acid

Downstream raw materials:

3-methyl-3-phenyl-heptane

2-Ethylhexyl alcohol

Refernces

• 1、 Gunes, Deniz,Sirkecioglu, Okan,Bicak, Niyazi. "Aliphatic thioethers by s-alkylation of thiols via trialkyl borates". body text. p. 1685 - 1690. Retrieved 2010/09/17.