4-[Benzo(B)thiophen-2-YL]benzoic acid

Base Information

• Chemical Name: 4-[Benzo(B)thiophen-2-YL]benzoic acid
• CAS No.: 19437-87-7
• Molecular Formula: C₁₅H₁₀O₂S
• Molecular Weight: 254.309
• DSSTox Substance ID: DTXSID801302409

Synonyms:19437-87-7;4-[BENZO(B)THIOPHEN-2-YL]BENZOIC ACID;4-[BENZO(B)THIOPHEN-2-YL]BENZOICACID;4-(benzo[b]thiophen-2-yl)benzoic acid;SCHEMBL731486;FYAQJZUNCVRASO-UHFFFAOYSA-N;4-Benzo[b]thien-2-ylbenzoic acid;DTXSID801302409;MFCD14636596

Chemical Property of 4-[Benzo(B)thiophen-2-YL]benzoic acid

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 254.04015073
• Heavy Atom Count: 18
• Complexity: 310

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(S2)C3=CC=C(C=C3)C(=O)O

Technology Process of 4-[Benzo(B)thiophen-2-YL]benzoic acid

There total 1 articles about 4-[Benzo(B)thiophen-2-YL]benzoic 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-(p-methoxycarbonylphenyl)benzothiophene (132932-63-9) → 4-(benzo[b]thiophen-2-yl)benzoic acid (19437-87-7)

Guidance literature:

2-(p-methoxycarbonylphenyl)benzothiophene; With sodium hydroxide; water; In methanol; for 3h; Heating / reflux;

With hydrogenchloride; In methanol; water;

upstream raw materials:

2-(p-methoxycarbonylphenyl)benzothiophene

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