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CS-W001157 4
Total: USD 88.00

(Benzylsulfonyl)benzene

  • CAS No. 3112-88-7

  • Cat. No. CS-0143425
  • Purity≥98%
  • MDL No.MFCD00025040

*For research and further manufacturing use only, not for direct human use.

(Benzylsulfonyl)benzene|CS-0143425

Structure of 3112-88-7

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General Information

  • CAS No. 3112-88-7
  • Cat. No. CS-0143425
  • Purity ≥98%
  • MDL No. MFCD00025040
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂O₂S
  • Molecular Weight 232.30
  • Synonym(s) Benzylphenylsulphone,
  • SMILES O=S(C1=CC=CC=C1)(CC2=CC=CC=C2)=O

Description

Benzylsulfonylbenzene features a robust sulfonyl linkage flanked by aromatic rings, delivering exceptional stability under standard bench conditions. This electron-deficient scaffold integrates seamlessly into cross-coupling workflows and serves as a reliable synthon in synthetic organic chemistry.

Application

(Benzylsulfonyl)benzene serves as a robust sulfonamide synthon in synthetic organic chemistry, enabling efficient construction of sulfonamide-containing scaffolds via nucleophilic displacement. Its benzylsulfonyl group exhibits excellent stability under standard reaction conditions and facilitates clean deprotection or functionalization. The molecule functions as a versatile building block for medicinal chemistry campaigns, particularly in the development of kinase inhibitors and other bioactive heterocycles, owing to its favorable solubility and compatibility with common coupling protocols.

Synthesis

  • Route1
    • null|null
      7417-81-4
    • ~96%
    • In-stock
      (Benzylsulfonyl)benzene|CS-0143425
      3112-88-7

    References

    • Bahrami, Kiumars; Khodaei, Mohammad M.; Sheikh Arabi, Mehdi Journal of Organic Chemistry, 2010 , vol. 75, # 18 p. 6208 - 6213
  • Route2

    References

    • Rahimizadeh, Mohammad; Rajabzadeh, Ghadir; Khatami, Seyed-Mola; Eshghi, Hossein; Shiri, Ali Journal of Molecular Catalysis A: Chemical, 2010 , vol. 323, # 1-2 p. 59 - 64
  • Route3
    • In-stock
      Sodium benzenesulfinate|CS-W014314
      873-55-2
    • null|null
      100-39-0
    • ~97%
    • In-stock
      (Benzylsulfonyl)benzene|CS-0143425
      3112-88-7

    References

    • Hu, Yi; Chen, Zhen-Chu; Le, Zhang-Gao; Zheng, Qin-Guo Journal of Chemical Research, 2004 , # 4 p. 267 - 269

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P302+P352-P304+P340

Quality Control

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   2.6605
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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