2-Benzyloxy-5-chlorophenyl acetic acid

Base Information

• Chemical Name: 2-Benzyloxy-5-chlorophenyl acetic acid
• CAS No.: 149428-98-8
• Molecular Formula: C15H13ClO3
• Molecular Weight: 276.719
• Hs Code.: 2918290090
• Mol file: 149428-98-8.mol

Synonyms:2-benzyloxy-5-chlorophenyl acetic acid;149428-98-8;2-(5-chloro-2-phenylmethoxyphenyl)acetic acid;2-Benzyloxy-5-chlorophenylaceticacid;SCHEMBL2110600;XMJBFDFCLGBCPG-UHFFFAOYSA-N;MFCD02664747;(2-benzyloxy-5-chlorophenyl)-acetic acid;5-Chloro-2-(benzyloxy)phenyl-acetic acid;{5-Chloro-2-[(phenylmethyl)oxy]phenyl}acetic acid;J-517277

Chemical Property of 2-Benzyloxy-5-chlorophenyl acetic acid

Chemical Property:

• Melting Point: 76 - 77.5 °C
• PSA: 46.53000
• LogP: 3.54610
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 276.0553220
• Heavy Atom Count: 19
• Complexity: 289

Purity/Quality:

2-Benzyloxy-5-chlorophenylaceticacid 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of 2-Benzyloxy-5-chlorophenyl acetic acid

There total 11 articles about 2-Benzyloxy-5-chlorophenyl 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:

ethyl (5-chloro-2-((phenylmethyl)oxy)phenyl)acetate (913649-93-1) → (5-chloro-2-((phenylmethyl)oxy)phenyl)acetic acid (149428-98-8)

Guidance literature:

With sodium hydroxide; In ethanol; Heating;

DOI:10.1016/j.bmcl.2008.01.071

Reference yield:

(5-chloro-2-((phenylmethyl)oxy)phenyl)acetonitrile (913649-99-7) → (5-chloro-2-((phenylmethyl)oxy)phenyl)acetic acid (149428-98-8)

Guidance literature:

With potassium hydroxide; In ethanol; for 4h; Heating;

DOI:10.1021/jm980212v

Reference yield:

2-(benzyloxy)-5-chlorobenzaldehyde (38544-16-0) → (5-chloro-2-((phenylmethyl)oxy)phenyl)acetic acid (149428-98-8)

Guidance literature:

Multi-step reaction with 4 steps

1: NaBH₄, 0.5N aq. NaOH / tetrahydrofuran / 2.5 h / Ambient temperature

2: SOCl₂ / tetrahydrofuran; dimethylformamide / 1 h / Ambient temperature

3: 18-crown-6 / acetonitrile / 7 h / Heating

4: aq. KOH / ethanol / 4 h / Heating

With potassium hydroxide; sodium hydroxide; sodium tetrahydroborate; thionyl chloride; 18-crown-6 ether; In tetrahydrofuran; ethanol; N,N-dimethyl-formamide; acetonitrile;

DOI:10.1021/jm980212v

upstream raw materials:

(5-chloro-2-((phenylmethyl)oxy)phenyl)acetonitrile

2-(benzyloxy)-5-chlorobenzaldehyde

benzyl bromide

5-chlorosalicyclaldehyde

Downstream raw materials:

2-({5-chloro-2-[(phenylmethyl)oxy]phenyl}methyl)-1,3-thiazole-4-carboxylic acid

Refernces

• 1、 -. "OXAZOLE AND THIAZOLE COMPOUNDS AND THEIR USE IN THE TREATMENT OF PGE2 MEDIATED DISORDERS". Page/Page column 29. . Retrieved 2010/11/24.
• 2、 -. "Alkoxyphenylalkylamine derivatives". . . Retrieved 2008/06/13.