Cas no 37526-67-3 (2-(Trifluoromethylthio)benzoic Acid)

2-(Trifluoromethylthio)benzoic acid is a fluorinated aromatic compound featuring a trifluoromethylthio (-SCF?) group attached to a benzoic acid scaffold. This structure imparts unique physicochemical properties, including enhanced lipophilicity and metabolic stability, making it valuable in pharmaceutical and agrochemical research. The trifluoromethylthio group is known for its strong electron-withdrawing effects, which can influence reactivity and binding interactions in molecular design. The compound serves as a versatile intermediate for synthesizing bioactive molecules, particularly in the development of enzyme inhibitors and receptor modulators. Its stability under various reaction conditions further enhances its utility in organic synthesis. Proper handling is advised due to potential reactivity of the thioether and carboxylic acid functional groups.
2-(Trifluoromethylthio)benzoic Acid structure
37526-67-3 structure
Product Name:2-(Trifluoromethylthio)benzoic Acid
CAS No:37526-67-3
MF:C8H5F3O2S
MW:222.184311628342
MDL:MFCD00236336
CID:2092937
Update Time:2025-10-29

2-(Trifluoromethylthio)benzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-((Trifluoromethyl)thio)benzoic acid
    • 2-(trifluoromethylsulfanyl)benzoic acid
    • 2-(Trifluoromethylthio)benzoic Acid
    • MDL: MFCD00236336
    • Inchi: 1S/C8H5F3O2S/c9-8(10,11)14-6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)
    • InChI Key: KYCFVGRNHSGPBJ-UHFFFAOYSA-N
    • SMILES: S(C(F)(F)F)C1C=CC=CC=1C(=O)O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3

2-(Trifluoromethylthio)benzoic Acid Pricemore >>

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2-(Trifluoromethylthio)benzoic Acid Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:37526-67-3)2-(Trifluoromethylthio)benzoic Acid
Order Number:A874079
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 09:42
Price ($):1597.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:37526-67-3)2-(Trifluoromethylthio)benzoic Acid
A874079
Purity:99%
Quantity:100g
Price ($):1597.0
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