Bis(trimethylsilyl) adipate

Base Information

• Chemical Name: Bis(trimethylsilyl) adipate
• CAS No.: 18105-31-2
• Molecular Formula: C12H26O4Si2
• Molecular Weight: 290.507
• Hs Code.: 2931900090
• European Community (EC) Number: 242-002-6
• DSSTox Substance ID: DTXSID6066311
• Nikkaji Number: J46.823A
• Wikidata: Q63392728
• Mol file: 18105-31-2.mol

Synonyms:Bis(trimethylsilyl) adipate;18105-31-2;Bis(trimethylsilyl) hexanedioate;BIS(TRIMETHYLSILYL)ADIPATE;Adipic acid, bis(trimethylsilyl) ester;Hexanedioic acid, 1,6-bis(trimethylsilyl) ester;Hexanedioic acid, bis(trimethylsilyl) ester;EINECS 242-002-6;hexanedioic acid bis(trimethylsilyl) ester;Adipic acid bis(trimethylsilyl);Adipate, bis-TMS;Adipic acid (tms);Adipic acid, diTMS;Adipic acid, bis-TMS;Adipic acid, (2TMS);SCHEMBL134075;C12H26O4Si2;Hexanedioic acid, di-TMS ester;DTXSID6066311;Hexanedioic acid, bis-TMS ester;C12-H26-O4-Si2;Hexanedioic acid, 2TMS derivative;BIS(TRIMETHYLSILYL) ADIPATE?;MFCD00051539;Adipic acid, di(trimethylsilyl) ester;AKOS037652978;FS-5947;A851818;Q63392728

Chemical Property of Bis(trimethylsilyl) adipate

Chemical Property:

• Vapor Pressure: 0.0362mmHg at 25°C
• Refractive Index: 1.4275
• Boiling Point: 241.3 °C at 760 mmHg
• Flash Point: 83 °C
• PSA: 52.60000
• Density: 0.952 g/cm³
• LogP: 3.30300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 290.13696238
• Heavy Atom Count: 18
• Complexity: 259

Purity/Quality:

98% ^*data from raw suppliers

BIS(TRIMETHYLSILYL) ADIPATE 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[Si](C)(C)OC(=O)CCCCC(=O)O[Si](C)(C)C

Technology Process of Bis(trimethylsilyl) adipate

There total 6 articles about Bis(trimethylsilyl) 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: 71.0%

Adipic acid (124-04-9) + 1,1,1,3,3,3-hexamethyl-disilazane (999-97-3) → Bis(trimethylsilyl) adipate (18105-31-2)

Guidance literature:

With iodine; In neat (no solvent); at 20 ℃; for 18h;

DOI:10.1016/j.tet.2016.08.003

Reference yield:

chloro-trimethyl-silane (75-77-4) + Adipic acid (124-04-9) → Bis(trimethylsilyl) adipate (18105-31-2)

Guidance literature:

Reference yield:

1,2-bis(trimethylsilyloxy)cyclohex-1-ene (6838-67-1) → Adipic acid (124-04-9) + Bis(trimethylsilyl) adipate (18105-31-2) + 2-hydroxy-2-cyclohexen-1-one (10316-66-2) + C12H24O4Si2 (128670-03-1,55494-10-5)

Guidance literature:

With oxygen; TPP 2. Florisil; In tetrachloromethane; at -20 ℃; for 0.05h; Product distribution; Irradiation;

DOI:10.1016/S0040-4039(00)88776-6

upstream raw materials:

chloro-trimethyl-silane

Adipic acid

1,2-bis(trimethylsilyloxy)cyclohex-1-ene

N,O-bis(trimethylsilyl)trifluoroacetamide

Downstream raw materials:

Ir(H)2(P(t)Bu2Ph)2(μ-η(2)-OC(O)(CH2)2C(O)O)Ir(H)2(P(t)Bu2Ph)

Ir(H)2(OC(O)(CH₂)4C(O)OSi(CH₃)3)(P(C(CH₃)3)2C₆H₅)2

1,6-hexanediol

Adipic acid

Refernces

• 1、 Kotowska, Urszula,Isidorov, Valery A.. "Partition coefficients of ketones, phenols, aliphatic and aromatic acids, and esters in n-hexane/nitromethane". scheme or table. p. 813 - 824. Retrieved 2012/03/27.
• 2、 Adam, Waldemar,Wang, Xiaoheng. "PHOTOOXYGENATION OF 1,2-BIS(SILYLOXY)CYCLOALKENES". . p. 1245 - 1248. Retrieved 2007/10/02.