Bis(tetrahydrofurfuryl) adipate

Base Information

• Chemical Name: Bis(tetrahydrofurfuryl) adipate
• CAS No.: 105-02-2
• Molecular Formula: C16H26 O6
• Molecular Weight: 314.379
• Hs Code.: 2932190090
• European Community (EC) Number: 203-262-6
• NSC Number: 9362
• DSSTox Substance ID: DTXSID60883295
• Nikkaji Number: J182.190C
• ChEMBL ID: CHEMBL1865720
• Mol file: 105-02-2.mol

Synonyms:105-02-2;Bis(tetrahydrofurfuryl)adipate;Bis(tetrahydrofurfuryl) adipate;bis(oxolan-2-ylmethyl) hexanedioate;Hexanedioic acid, bis[(tetrahydro-2-furanyl)methyl] ester;MLS002638086;NSC 9362;EINECS 203-262-6;Adipic acid, bis(tetrahydrofurfuryl) ester;Hexanedioic acid, bis((tetrahydro-2-furanyl)methyl) ester;Hexanedioic acid, 1,6-bis((tetrahydro-2-furanyl)methyl) ester;Hexanedioic acid, 1,6-bis[(tetrahydro-2-furanyl)methyl] ester;ditetrahydrofurfuryl adipate;bis(tetrahydrofurfuryl)adipat;SCHEMBL1065164;CHEMBL1865720;DTXSID60883295;NSC9362;HMS3079J19;NSC-9362;SMR001547579;adipic acid bis-(tetrahydro-furfuryl) ester;bis(tetrahydro-2-furanylmethyl) hexanedioate;Hexanedioic acid bis[(tetrahydrofuran-2-yl)methyl] ester

Chemical Property of Bis(tetrahydrofurfuryl) adipate

Chemical Property:

• Vapor Pressure: 1.3E-07mmHg at 25°C
• Boiling Point: 430.4°C at 760 mmHg
• Flash Point: 188.4°C
• PSA: 71.06000
• Density: 1.126g/cm³
• LogP: 1.99120
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 314.17293854
• Heavy Atom Count: 22
• Complexity: 323

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(OC1)COC(=O)CCCCC(=O)OCC2CCCO2

Technology Process of Bis(tetrahydrofurfuryl) adipate

There total 3 articles about Bis(tetrahydrofurfuryl) adipate 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:

Tetrahydrofurfuryl alcohol (97-99-4) + adipic acid diisopropyl ester (6938-94-9,121879-14-9) → adipic acid isopropyl ester-tetrahydrofurfuryl ester (97159-24-5) + hexanedioic acid bis-tetrahydrofurfuryl ester (105-02-2)

Guidance literature:

With aluminum isopropoxide; at 170 ℃;

Reference yield:

Tetrahydrofurfuryl alcohol (97-99-4) + Adipic acid (124-04-9) → hexanedioic acid bis-tetrahydrofurfuryl ester (105-02-2)

Guidance literature:

With sulfuric acid; 1,2-dichloro-ethane;

Reference yield:

→ hexanedioic acid bis-tetrahydrofurfuryl ester (105-02-2)

Guidance literature:

DOI:10.1021/je60005a015

upstream raw materials:

Tetrahydrofurfuryl alcohol

Adipic acid

adipic acid diisopropyl ester