(Trimethylsilyl)methyl trifluoromethanesulfonate

Base Information

• Chemical Name: (Trimethylsilyl)methyl trifluoromethanesulfonate
• CAS No.: 64035-64-9
• Molecular Formula: C5H11F3O3SSi
• Molecular Weight: 236.287
• Hs Code.: 29319090
• European Community (EC) Number: 628-446-7
• DSSTox Substance ID: DTXSID00375381
• Nikkaji Number: J364.740D
• Wikidata: Q72514519
• Mol file: 64035-64-9.mol

Synonyms:(Trimethylsilyl)methyl trifluoromethanesulfonate;64035-64-9;Trimethylsilylmethyl triflate;trimethylsilylmethyl trifluoromethanesulfonate;(Trimethylsilyl)methyl Triflate;Trimethylsiylmethyltrifluoromethanesulfnate;Methanesulfonic acid, trifluoro-, (trimethylsilyl)methyl ester;Trimethylsilylmethyltrifluoromethanesulfonate;C5H11F3O3SSi;trimethylsilylmethyl trifluoromethanesulphonate;SCHEMBL496480;DTXSID00375381;MFCD00009914;AKOS015904486;FS-4689;CS-0204466;FT-0640917;T1579;T72761;(Trimethylsilyl)methyl trifluoromethanesulfonate, 96%;Trifluoromethanesulfonic acid trimethylsilylmethyl ester;Trifluoromethanesulfonic Acid (Trimethylsilyl)methyl Ester;(Trimethylsilyl)methyl trifluoromethanesulfonate, purum, >=98.0% (GC);(TRIMETHYLSILYL)METHYL TRIFLUOROMETHANESULFONATE [TRIMETHYLSILYLMETHYLATING REAGENT]

Chemical Property of (Trimethylsilyl)methyl trifluoromethanesulfonate

Chemical Property:

• Appearance/Colour: clear yellow-orange liquid
• Vapor Pressure: 2.1mmHg at 25°C
• Melting Point: <0 ºC
• Refractive Index: n20/D 1.376(lit.)
• Boiling Point: 168.8 ºC at 760 mmHg
• Flash Point: 60 ºC
• PSA: 51.75000
• Density: 1.239 g/cm³
• LogP: 3.22910
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 236.01502640
• Heavy Atom Count: 13
• Complexity: 258

Purity/Quality:

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

(Trimethylsilyl)methyl Trifluoromethanesulfonate [Trimethylsilylmethylating Reagent] >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 10-34
• Safety Statements: 26-28-36/37/39-45-16

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[Si](C)(C)COS(=O)(=O)C(F)(F)F

Technology Process of (Trimethylsilyl)methyl trifluoromethanesulfonate

There total 3 articles about (Trimethylsilyl)methyl trifluoromethanesulfonate 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%

(trimethylsilyl)methanol (3219-63-4) + trifluoromethylsulfonic anhydride (358-23-6) → Trimethylsilylmethyl trifluoromethanesulfonate (64035-64-9)

Guidance literature:

In dichloromethane; at 25 ℃; for 2h;

DOI:10.1021/jm00161a019

Reference yield: 81.0%

diazomethane (186581-53-3,908094-01-9,334-88-3) + trimethylsilyl trifluoromethanesulfonate (27607-77-8) → Trimethylsilylmethyl trifluoromethanesulfonate (64035-64-9)

Guidance literature:

In diethyl ether; at -10 ℃; for 1h;

DOI:10.1055/s-1988-27554

Reference yield:

→ Trimethylsilylmethyl trifluoromethanesulfonate (64035-64-9)

Guidance literature:

DOI:10.1021/ja00515a061

upstream raw materials:

(trimethylsilyl)methanol

trifluoromethylsulfonic anhydride

diazomethane

trimethylsilyl trifluoromethanesulfonate

Downstream raw materials:

10b,11,17a,18-tetrahydro-11,11,18,18-tetramethyl-17a-phenyl-6H,17H,diindolo<1,2-a:1,2-d>benzo<1,4>diazocine

dimethyl rel-(1R,2S,9aR)-2,3,9,9a-tetrahydro-9,9-dimethyl-9a-phenyl-1H-pyrrolo<1,2-a>indole-1,2-dicarboxylate

dimethyl rel-(1S,2R,9aR)-2,3,9,9a-tetrahydro-9,9-dimethyl-9a-phenyl-1H-pyrrolo<1,2-a>indole-1,2-dicarboxylate

dimethyl 9,9a-dihydro-9,9-dimethyl-9a-phenyl-1H-pyrrolo<1,2a>indole-1,2-dicarboxylate

Refernces

• 1、 -. "RAPAMYCIN ANALOGS AS ANTI-CANCER AGENTS". Page/Page column 42.1. . Retrieved 2009/12/05.
• 2、 Anderson, Wayne K.,Milowsky, Arnold S.. "Synthesis and Antineoplastic Activity of Bisoxy>methyl>-Substituted 3-Pyrrolines as Prodrugs of Tumor Inhibitory Pyrrole Bis(carbamates)". . p. 2241 - 2249. Retrieved 2007/10/02.