3-Amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester

Base Information

Chemical Name:3-Amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester
CAS No.:283173-77-3
Molecular Formula:C₁₆H₁₂ClNO₂
Molecular Weight:285.73
Hs Code.:
DSSTox Substance ID:DTXSID401219262

Synonyms:3-amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester;283173-77-3;SCHEMBL4998544;SYGOQAQLBWAQIH-UHFFFAOYSA-N;DTXSID401219262;DB-217913;methyl 3-amino-2-[2-(4-chlorophenyl)ethynyl]benzoate

Suppliers and Price of 3-Amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester

Supply Marketing:

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

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Chemical Property of 3-Amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester

Chemical Property:

XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:285.0556563
Heavy Atom Count:20
Complexity:403

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=C(C(=CC=C1)N)C#CC2=CC=C(C=C2)Cl

Technology Process of 3-Amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester

There total 2 articles about 3-Amino-2-(4-chloro-phenylethynyl)-benzoic acid 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:

: 873-73-4
4-n-chlorophenylacetylene

: 93415-79-3
methyl 2-iodo-3-nitrobenzoate

: argon

: 7681-65-4
copper(I) iodide

: 283173-77-3
3-amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester

Guidance literature:: With triethylamine; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In toluene;

Reference yield:

: 5398-69-6
2-iodo-3-nitrobenzoic acid

: 283173-77-3
3-amino-2-(4-chloro-phenylethynyl)-benzoic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: sulfuric acid; trimethyl orthoformate / methanol

2: triethylamine / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / toluene

With sulfuric acid; triethylamine; trimethyl orthoformate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In methanol; toluene;