4-Fluoro-3-(methylsulfanyl)benzoic acid

Base Information

• Chemical Name: 4-Fluoro-3-(methylsulfanyl)benzoic acid
• CAS No.: 169310-01-4
• Molecular Formula: C8H7FO2S
• Molecular Weight: 0.00000
• European Community (EC) Number: 858-401-9
• Nikkaji Number: J2.155.326C
• Mol file: 169310-01-4.mol

Synonyms:4-fluoro-3-(methylsulfanyl)benzoic acid;169310-01-4;4-fluoro-3-(methylthio)benzoic acid;4-fluoro-3-methylsulfanylbenzoic acid;4-fluoro-3-(methylthio)benzoicacid;MFCD20657082;AKOS017531699;CS-0194977;E92013;EN300-123209;Z1262553189

Chemical Property of 4-Fluoro-3-(methylsulfanyl)benzoic acid

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 186.01507880
• Heavy Atom Count: 12
• Complexity: 174

Purity/Quality:

98% ^*data from raw suppliers

4-Fluoro-3-(methylsulfanyl)benzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CSC1=C(C=CC(=C1)C(=O)O)F
• Uses: 4-Fluoro-3-(methylsulfanyl)benzoic acid is used in the regioselective metalation and functionalization of unprotected halobenzoic acids with different metalating agents.

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