Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester

Base Information

Chemical Name:Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester
CAS No.:110166-76-2
Molecular Formula:C14H18O2Si
Molecular Weight:246.381
Hs Code.:
DSSTox Substance ID:DTXSID80444084
Nikkaji Number:J1.195.451K
Wikidata:Q82262095
Mol file:110166-76-2.mol

Synonyms:Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester;DTXSID80444084;2-(Trimethylsilylethynyl)benzoic acid ethyl ester

Suppliers and Price of Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemicals and raw materials
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Total 1 raw suppliers

Chemical Property of Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester

Chemical Property:

Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:246.107606347
Heavy Atom Count:17
Complexity:329

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=CC=CC=C1C#C[Si](C)(C)C

Technology Process of Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester

There total 3 articles about Benzoic acid, 2-[(trimethylsilyl)ethynyl]-, ethyl ester 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: 98.0%

: 6091-64-1
2-bromobenzoic acid ethyl ester

: 1066-54-2
trimethylsilylacetylene

: 110166-76-2
ethyl 2-((trimethylsilyl)ethynyl)benzoate

Guidance literature:: With copper(l) iodide; triethylamine; bis-triphenylphosphine-palladium(II) chloride; at 120 ℃; for 1h;
DOI:10.1248/cpb.34.2754

Reference yield: 92.0%

: 1066-54-2
trimethylsilylacetylene

: 110166-76-2
ethyl 2-((trimethylsilyl)ethynyl)benzoate

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; N-ethyl-N,N-diisopropylamine; at 20 ℃;
DOI:10.1021/acs.orglett.9b03999

Reference yield: 89.0%

: 1829-28-3
ethyl 2-iodobenzoate

: 1066-54-2
trimethylsilylacetylene

: 110166-76-2
ethyl 2-((trimethylsilyl)ethynyl)benzoate

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; diisopropylamine; In tetrahydrofuran;
DOI:10.1021/jo990810x