2-(Benzyloxy)-5-chlorobenzoic acid

Base Information

• Chemical Name: 2-(Benzyloxy)-5-chlorobenzoic acid
• CAS No.: 52803-75-5
• Molecular Formula: C14H11ClO3
• Molecular Weight: 262.693
• DSSTox Substance ID: DTXSID80391221
• Mol file: 52803-75-5.mol

Synonyms:2-(benzyloxy)-5-chlorobenzoic acid;52803-75-5;5-chloro-2-phenylmethoxybenzoic acid;HMS1604O08;SCHEMBL487486;2-benzyloxy-5-chlorobenzoic acid;DTXSID80391221;ULFLACGIFMTNGR-UHFFFAOYSA-N;2-(benzyloxy)-5-chlorobenzoicacid;BBL013590;MFCD02668668;STK500341;AKOS005061916;VS-03879;5-Chloro-2-[(phenylmethyl)oxy]benzoic acid;CS-0190928;E89648

Chemical Property of 2-(Benzyloxy)-5-chlorobenzoic acid

Chemical Property:

• PSA: 46.53000
• LogP: 3.61720
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 262.0396719
• Heavy Atom Count: 18
• Complexity: 276

Purity/Quality:

98%min ^*data from raw suppliers

2-(Benzyloxy)-5-chlorobenzoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C(=O)O

Technology Process of 2-(Benzyloxy)-5-chlorobenzoic acid

There total 8 articles about 2-(Benzyloxy)-5-chlorobenzoic 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: 98.0%

methyl 5-chloro-2-(phenylmethoxy)benzoate (103620-87-7) → 2-(benzyloxy)-5-chlorobenzoic acid (52803-75-5)

Guidance literature:

With water; lithium hydroxide; In tetrahydrofuran; at 20 ℃; for 16h;

DOI:10.1016/j.bmcl.2017.07.052

Reference yield: 90.3%

5-chloro-2-hydroxybenzoic acid (321-14-2) + benzyl chloride (100-44-7) → 2-(benzyloxy)-5-chlorobenzoic acid (52803-75-5)

Guidance literature:

5-chloro-2-hydroxybenzoic acid; benzyl chloride; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃;

With sodium hydroxide; In tetrahydrofuran; methanol; for 12h;

DOI:10.1016/j.ejmech.2021.113203

Reference yield: 90.3%

5-chloro-2-hydroxybenzoic acid (321-14-2) + benzyl bromide (100-39-0) → 2-(benzyloxy)-5-chlorobenzoic acid (52803-75-5)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃;

upstream raw materials:

thiophene

5-chloro-2-hydroxybenzoic acid

benzyl chloride

methyl 5-chloro-2-(phenylmethoxy)benzoate

Downstream raw materials:

2-benzyloxy-5-chloro-N-(1⁽²⁾H-tetrazol-5-yl)-benzamide

2-benzyloxy-5-chlorobenzoic acid chloride

1-(2-benzyloxy-5-chloro-phenyl)-3-[1,3]dioxolan-2-yl-propan-1-one

3-[2-(5-chloro-2-benzyloxy-phenyl)-pyrrol-1-yl]-benzoic acid ethyl ester