2-(4-Chloro-3-methoxyphenyl)acetic acid

Base Information

• Chemical Name: 2-(4-Chloro-3-methoxyphenyl)acetic acid
• CAS No.: 13726-19-7
• Molecular Formula: C9H9ClO3
• Molecular Weight: 200.622
• Hs Code.: 2918990090
• European Community (EC) Number: 823-660-9
• DSSTox Substance ID: DTXSID50608116
• Wikidata: Q82507227
• Mol file: 13726-19-7.mol

Synonyms:13726-19-7;2-(4-Chloro-3-methoxyphenyl)acetic acid;(4-Chloro-3-methoxyphenyl)acetic acid;Benzeneacetic acid, 4-chloro-3-methoxy-;2-(4-Chloro-3-methoxyphenyl)aceticacid;SCHEMBL586214;DTXSID50608116;HYHHKCKVSWCDHJ-UHFFFAOYSA-N;4-chloro-3-methoxyphenylacetic acid;MFCD09924912;4-Chloro-3-methoxyphenyl-acetic acid;AKOS016009135;AT23094;DB-354815;CS-0044683;EN300-243914;Z1269148038

Chemical Property of 2-(4-Chloro-3-methoxyphenyl)acetic acid

Chemical Property:

• PSA: 46.53000
• LogP: 1.97570
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 200.0240218
• Heavy Atom Count: 13
• Complexity: 184

Purity/Quality:

99% ^*data from raw suppliers

2-(4-Chloro-3-methoxyphenyl)aceticacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)CC(=O)O)Cl

Technology Process of 2-(4-Chloro-3-methoxyphenyl)acetic acid

There total 12 articles about 2-(4-Chloro-3-methoxyphenyl)acetic 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:

2-(4-chloro-3-methoxyphenyl)acetonitrile (13726-21-1) → 2-(4-chloro-3-methoxyphenyl)acetic acid (13726-19-7)

Guidance literature:

With potassium hydroxide;

Reference yield:

(4-chloro-3-methoxyphenyl)methan-1-ol (13726-17-5) → 2-(4-chloro-3-methoxyphenyl)acetic acid (13726-19-7)

Guidance literature:

Multi-step reaction with 3 steps

1: SOCl₂, Py / diethyl ether / Heating

3: aq. KOH

With pyridine; potassium hydroxide; thionyl chloride; In diethyl ether;

Reference yield:

1-chloro-4-chloromethyl-2-methoxybenzene (13726-18-6) → 2-(4-chloro-3-methoxyphenyl)acetic acid (13726-19-7)

Guidance literature:

Multi-step reaction with 2 steps

2: aq. KOH

With potassium hydroxide;

upstream raw materials:

2-(4-chloro-3-methoxyphenyl)acetonitrile

4-chloro-3-methoxybenzaldehyde

(4-chloro-3-methoxyphenyl)methan-1-ol

2-chloro-5-nitroanisole

Downstream raw materials:

(4-Chloro-3-hydroxyphenyl) acetic acid methyl ester

2-(4-chloro-3-hydroxyphenyl)acetic acid

methyl 2-(4-chloro-3-methoxyphenyl)acetate