4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate

Base Information

Chemical Name:4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate
CAS No.:65195-02-0
Molecular Formula:C₂₉H₃₁NO₂
Molecular Weight:425.571
Hs Code.:
DSSTox Substance ID:DTXSID60708419
Wikidata:Q82642730

Synonyms:65195-02-0;DTXSID60708419;4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate;4'-Pentyl-biphenyl-4-carboxylic acid 4-butyl-2-cyano-phenyl ester

Suppliers and Price of 4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate

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
Packaging
price

Total 1 raw suppliers

Chemical Property of 4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate

Chemical Property:

XLogP3:9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:11
Exact Mass:425.235479232
Heavy Atom Count:32
Complexity:592

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CCCC)C#N

Technology Process of 4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate

There total 8 articles about 4-Butyl-2-cyanophenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate 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: 64.0%

: 59748-37-7
4'-n-pentyl-<1,1'-biphenyl>-4-carboxylic acid chloride

: 52899-63-5
5-butyl-2-hydroxybenzonitrile

: 65195-02-0
4-n-pentylbiphenyl-(4')-carboxylic acid (2-cyano-4-n-butylphenyl) ester

Guidance literature:: In pyridine; toluene; for 3h; Heating;

Reference yield:

: 1638-22-8
4-n-butylphenol

: 65195-02-0
4-n-pentylbiphenyl-(4')-carboxylic acid (2-cyano-4-n-butylphenyl) ester

Guidance literature:: Multi-step reaction with 5 steps

1: Br₂ / dioxane / 4 h / Ambient temperature

2: pyridine / 4 h / Ambient temperature

3: 2.) FeCl₃, conc HCl / 1.) DMF, 152 deg C, 7 h; 2.) DMF, water, 65 - 70 deg C, 20 min

4: 58 percent / NaOH / aq. ethanol / 1 h / Heating

5: 64 percent / toluene; pyridine / 3 h / Heating

With hydrogenchloride; sodium hydroxide; bromine; iron(III) chloride; In 1,4-dioxane; pyridine; ethanol; toluene;

Reference yield:

: 74317-78-5
2-bromo 4-butylphenol

: 65195-02-0
4-n-pentylbiphenyl-(4')-carboxylic acid (2-cyano-4-n-butylphenyl) ester

Guidance literature:: Multi-step reaction with 4 steps

1: pyridine / 4 h / Ambient temperature

2: 2.) FeCl₃, conc HCl / 1.) DMF, 152 deg C, 7 h; 2.) DMF, water, 65 - 70 deg C, 20 min

3: 58 percent / NaOH / aq. ethanol / 1 h / Heating

4: 64 percent / toluene; pyridine / 3 h / Heating

With hydrogenchloride; sodium hydroxide; iron(III) chloride; In pyridine; ethanol; toluene;