Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl ester

Base Information

Chemical Name:Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl ester
CAS No.:685887-85-8
Molecular Formula:C26H34O3
Molecular Weight:394.554
Hs Code.:
DSSTox Substance ID:DTXSID20464241
Wikidata:Q82289497

Synonyms:685887-85-8;Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl ester;SCHEMBL15471696;DTXSID20464241

Suppliers and Price of Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl ester

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 2 raw suppliers

Chemical Property of Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl ester

Chemical Property:

XLogP3:7.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:14
Exact Mass:394.25079494
Heavy Atom Count:29
Complexity:457

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CCCCCCCCCCC(=O)OC

Technology Process of Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl ester

There total 11 articles about Benzeneundecanoic acid, 4-(4-methylbenzoyl)-, methyl 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: 93.0%

: 111-81-9
Methyl 10-undecenoate

: 76693-57-7
(4-bromophenyl)(p-tolyl)methanone

: 685887-85-8
methyl 11-[4-(4-methylbenzoyl)-phenyl]-undecanoate

Guidance literature:: Methyl 10-undecenoate; With 9-borabicyclo[3.3.1]nonane dimer; In tetrahydrofuran; at 20 ℃; for 3h;

(4-bromophenyl)(p-tolyl)methanone; With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; triphenyl-arsane; caesium carbonate; In tetrahydrofuran; water; N,N-dimethyl-formamide; at 20 ℃; for 22h;

Reference yield: 23.0%

: 874-60-2
4-methyl-benzoyl chloride

: 19966-45-1
ω-phenyl undecanoic acid methyl ester

: 685887-85-8
methyl 11-[4-(4-methylbenzoyl)-phenyl]-undecanoate

Guidance literature:: With aluminium trichloride; In dichloromethane; for 1h; Heating;

Reference yield:

: 108-88-3,15644-74-3,16713-13-6
toluene

: 685887-85-8
methyl 11-[4-(4-methylbenzoyl)-phenyl]-undecanoate

Guidance literature:: Multi-step reaction with 2 steps

1.1: 89 percent / AlCl₃ / 3 h / Heating

2.1: 9-BBN / tetrahydrofuran / 3 h / 20 °C

2.2: 93 percent / Cs₂CO₃; Ph₃As; Pd(dppf)Cl₂ / dimethylformamide; tetrahydrofuran; H₂O / 22 h / 20 °C

With 9-borabicyclo[3.3.1]nonane dimer; aluminium trichloride; In tetrahydrofuran; 1.1: Friedel-Crafts reaction;