Cas no 100059-51-6 (4-(Butane-1-sulfonyl)benzoic Acid)

4-(Butane-1-sulfonyl)benzoic acid is a sulfone-containing benzoic acid derivative with applications in organic synthesis and pharmaceutical research. Its structure features a butylsulfonyl group at the para position of the benzoic acid ring, contributing to its unique reactivity and solubility properties. This compound is particularly useful as an intermediate in the synthesis of more complex molecules, including potential drug candidates, due to its ability to act as a versatile building block. The sulfonyl group enhances electrophilic character, facilitating further functionalization. It is typically handled under standard laboratory conditions, with stability in dry environments. The product is characterized by high purity, ensuring reliable performance in synthetic applications.
4-(Butane-1-sulfonyl)benzoic Acid structure
100059-51-6 structure
Product Name:4-(Butane-1-sulfonyl)benzoic Acid
CAS No:100059-51-6
MF:C11H14O4S
MW:242.291462421417
MDL:MFCD09935862
CID:172685
PubChem ID:180763
Update Time:2025-05-27

4-(Butane-1-sulfonyl)benzoic Acid Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,4-(butylsulfonyl)-
    • Benzoicacid, p-(butylsulfonyl)- (6CI)
    • 4-butylsulfonylbenzoic acid
    • 4-(Butane-1-sulfonyl)benzoic Acid
    • MDL: MFCD09935862
    • Inchi: 1S/C11H14O4S/c1-2-3-8-16(14,15)10-6-4-9(5-7-10)11(12)13/h4-7H,2-3,8H2,1H3,(H,12,13)
    • InChI Key: ZBKOZGCANJUKEY-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(C(=O)O)=CC=1)(CCCC)(=O)=O

Computed Properties

  • Exact Mass: 242.06132

Experimental Properties

  • PSA: 71.44

4-(Butane-1-sulfonyl)benzoic Acid Pricemore >>

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