[2-(4-Fluorophenyl)-1,3-thiazol-4-yl]acetic acid

Base Information

• Chemical Name: [2-(4-Fluorophenyl)-1,3-thiazol-4-yl]acetic acid
• CAS No.: 17969-24-3
• Molecular Formula: C11H8 F N O2 S
• Molecular Weight: 237.25
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID60368956
• Wikidata: Q82155873
• ChEMBL ID: CHEMBL1405091
• Mol file: 17969-24-3.mol

Synonyms:17969-24-3;[2-(4-fluorophenyl)-1,3-thiazol-4-yl]acetic acid;2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]acetic Acid;2-(2-(4-fluorophenyl)thiazol-4-yl)acetic acid;[2-(4-Fluorophenyl)thiazol-4-yl]acetic acid;MFCD06366744;2-(4-FLUOROPHENYL)-1,3-THIAZOL-4-YL]ACETIC ACID;MLS001002655;SCHEMBL9555570;CHEMBL1405091;DTXSID60368956;HMS2733I23;BBL030501;STK727302;AKOS002669768;SMR000369245;VS-09851;CS-0308301;FT-0683856;EN300-11442;2-(2-(4-fluorophenyl)thiazol-4-yl)aceticacid;A881230;Z57046960

Chemical Property of [2-(4-Fluorophenyl)-1,3-thiazol-4-yl]acetic acid

Chemical Property:

• Vapor Pressure: 1.16E-07mmHg at 25°C
• Boiling Point: 415.9°Cat760mmHg
• Flash Point: 205.3°C
• PSA: 78.43000
• Density: g/cm³
• LogP: 2.57630
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 237.02597783
• Heavy Atom Count: 16
• Complexity: 256

Purity/Quality:

97% ^*data from raw suppliers

[2-(4-Fluorophenyl)-1,3-thiazol-4-yl]acetic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=NC(=CS2)CC(=O)O)F

Technology Process of [2-(4-Fluorophenyl)-1,3-thiazol-4-yl]acetic acid

There total 1 articles about [2-(4-Fluorophenyl)-1,3-thiazol-4-yl]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-Fluorphenyl)thiazol-4-ylessigsaeure (17969-24-3)

Guidance literature:

2-(4-Fluorphenyl)-4-cyanmethylthiazol, HCl;

Reference yield: 69.0%

acetic anhydride (108-24-7) + 2,4-Dihydroxybenzaldehyde (95-01-2) + 2-(4-Fluorphenyl)thiazol-4-ylessigsaeure (17969-24-3) → 3-[2-(4-fluorophenyl)-1,3-thiazolyl-4-yl]-2-oxo-2H-chromen-7-yl acetate

Guidance literature:

With pyridine; for 12h; Reflux;

DOI:10.1007/s10600-019-02882-6

Reference yield:

2-(4-Fluorphenyl)thiazol-4-ylessigsaeure (17969-24-3) → 3-tert-butyl-6-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-7H-furo[3,2-g]chromen-7-one

Guidance literature:

Multi-step reaction with 4 steps

1: pyridine / 12 h / Reflux

2: ammonium hydroxide / ethanol / 5 h / 20 °C

3: potassium carbonate / N,N-dimethyl-formamide; acetone / Heating

4: sodium hydroxide / isopropyl alcohol / Heating

With pyridine; ammonium hydroxide; potassium carbonate; sodium hydroxide; In ethanol; N,N-dimethyl-formamide; isopropyl alcohol; acetone; 3: |Williamson Ether Synthesis;

DOI:10.1007/s10600-019-02882-6

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