4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid

Base Information

Chemical Name:4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid
CAS No.:61439-49-4
Molecular Formula:C20H17NO2
Molecular Weight:303.36
Hs Code.:
ChEMBL ID:CHEMBL28364
DSSTox Substance ID:DTXSID30517530
Wikidata:Q82379617

Synonyms:61439-49-4;CHEMBL28364;4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid;SCHEMBL11257944;DTXSID30517530;AKOS002633715

Suppliers and Price of 4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid

Supply Marketing:

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

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Chemical Property of 4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:303.125928785
Heavy Atom Count:23
Complexity:362

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=CC=C(C=C2)CNC3=CC=C(C=C3)C(=O)O

Technology Process of 4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid

There total 5 articles about 4-{[([1,1'-Biphenyl]-4-yl)methyl]amino}benzoic acid 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: 67.0%

: 61439-48-3
p-<(4-Biphenylmethyl)amino>benzoesaeureethylester

: 61439-49-4
p-<(4-Biphenylmethyl)amino>benzoesaeure

Guidance literature:: With potassium hydroxide; In ethanol; for 5h; Heating;
DOI:10.1021/jm00364a009

Reference yield:

: 2567-29-5
p-phenylbenzyl bromide

: 61439-49-4
p-<(4-Biphenylmethyl)amino>benzoesaeure

Guidance literature:: Multi-step reaction with 2 steps

1: 39 percent / hexamethylphosphoric acid triamide / 24 h / 125 °C

2: 67 percent / KOH / aq. ethanol / 5 h / Heating

With potassium hydroxide; In N,N,N,N,N,N-hexamethylphosphoric triamide; ethanol;
DOI:10.1021/jm00364a009

Reference yield:

: 94-09-7
p-aminoethylbenzoate

: 61439-49-4
p-<(4-Biphenylmethyl)amino>benzoesaeure

Guidance literature:: Multi-step reaction with 2 steps

1: 39 percent / hexamethylphosphoric acid triamide / 24 h / 125 °C

2: 67 percent / KOH / aq. ethanol / 5 h / Heating

With potassium hydroxide; In N,N,N,N,N,N-hexamethylphosphoric triamide; ethanol;
DOI:10.1021/jm00364a009