Methyl 3-(1-benzothien-3-yl)benzoate

Base Information

Chemical Name:Methyl 3-(1-benzothien-3-yl)benzoate
CAS No.:24251-07-8
Molecular Formula:C₁₆H₁₂O₂S
Molecular Weight:268.336
Hs Code.:
DSSTox Substance ID:DTXSID501293908
Nikkaji Number:J3.470.910F

Synonyms:methyl 3-(1-benzothien-3-yl)benzoate;SCHEMBL8442885;DTXSID501293908;Methyl 3-benzo[b]thien-3-ylbenzoate;AKOS004114121;24251-07-8;BB 0222800;3-(Benzo[b]thiophene-3-yl)benzoic acid methyl ester

Suppliers and Price of Methyl 3-(1-benzothien-3-yl)benzoate

Supply Marketing:

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

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Chemical Property of Methyl 3-(1-benzothien-3-yl)benzoate

Chemical Property:

XLogP3:4.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:268.05580079
Heavy Atom Count:19
Complexity:331

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=CC=CC(=C1)C2=CSC3=CC=CC=C32

Technology Process of Methyl 3-(1-benzothien-3-yl)benzoate

There total 3 articles about Methyl 3-(1-benzothien-3-yl)benzoate 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: 79.0%

: 1356823-24-9
C₁₃H₁₄BNO₆

: 95-15-8,11095-43-5
Benzo[b]thiophene

: 24251-07-8
methyl 3-(benzo[b]thiophene-3-yl)benzoate

Guidance literature:: With trifluorormethanesulfonic acid; C₂₄H₃₆N₂O₂Pd*2C₂H₄O₂; cesium trifluoroacetate; trifluoroacetic acid; p-benzoquinone; silver(l) oxide; In water; at 30 ℃; for 20h; regioselective reaction;
DOI:10.1055/s-0034-1379606

Reference yield:

: 24257-35-0
C₁₅H₁₀O₂S

: 74-88-4
methyl iodide

: 24251-07-8
methyl 3-(benzo[b]thiophene-3-yl)benzoate

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 10h; Schlenk technique; Inert atmosphere;
DOI:10.1021/ol3029109

Reference yield:

: 22515-29-3
methyl 3-(trimethylsilyl)benzoate

: 95-15-8,11095-43-5
Benzo[b]thiophene

: 24251-07-8
methyl 3-(benzo[b]thiophene-3-yl)benzoate

: 1023489-11-3
C₁₆H₁₂O₂S

Guidance literature:: With dichloro bis(acetonitrile) palladium(II); 1,2-dichloro-ethane; copper dichloride; In toluene; at 100 ℃; for 16h; Overall yield = 63 %; Overall yield = 84 mg; regioselective reaction; Inert atmosphere;
DOI:10.1021/ol3029109