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CS-W001157 4
Total: USD 88.00

Ethyl 2-(phenylsulfonyl)acetate

  • CAS No. 7605-30-3

  • Cat. No. CS-0151564
  • Purity≥98%
  • MDL No.MFCD00025041

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

Ethyl 2-(phenylsulfonyl)acetate|CS-0151564

Structure of 7605-30-3

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General Information

  • CAS No. 7605-30-3
  • Cat. No. CS-0151564
  • Purity ≥98%
  • MDL No. MFCD00025041
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₄S
  • Molecular Weight 228.26
  • Synonym(s) Phenylsulfonylacetic Acid Ethyl Ester
  • SMILES CCOC(=O)CS(=O)(=O)C1=CC=CC=C1

Description

Ethyl 2-(phenylsulfonyl)acetate features a sulfone-embedded acetic acid ester scaffold, delivering high stability and predictable reactivity in nucleophilic substitution processes. The phenylsulfonyl group enhances electrophilicity at the α-carbon, enabling efficient C–C bond formation under mild conditions. This bench-stable reagent integrates readily into synthetic sequences requiring controlled carbonyl functionalization.

Application

Ethyl 2-(phenylsulfonyl)acetate serves as a versatile synthon in organic synthesis, enabling efficient access to sulfonamide-containing scaffolds and functionalized heterocycles. Its electrophilic α-carbon facilitates nucleophilic substitution and enolate-mediated transformations under mild conditions. The molecule exhibits excellent bench stability, minimal side reactivity, and compatibility with diverse functional groups, simplifying purification and scalability in medicinal chemistry and process development workflows.

Synthesis

  • Route1
    • Ethyl 2-(phenylthio)acetate|CS-W010589
      7605-25-6
    • ~99%
    • In-stock
      Ethyl 2-(phenylsulfonyl)acetate|CS-0151564
      7605-30-3

    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
  • Route2
    • Ethyl 2-(phenylthio)acetate|CS-W010589
      7605-25-6
    • ~4%
    • In-stock
      Ethyl 2-(phenylsulfonyl)acetate|CS-0151564
      7605-30-3
    • Ethyl 2-(phenylsulfinyl)acetate|CS-0453529
      54882-04-1

    References

    • Bulletin of the Chemical Society of Japan, , vol. 69, # 10 p. 2955 - 2959
  • Route3
    • In-stock
      Sodium benzenesulfinate|CS-W014314
      873-55-2
    • null|null
      105-39-5
    • ~91%
    • In-stock
      Ethyl 2-(phenylsulfonyl)acetate|CS-0151564
      7605-30-3

    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-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.44
  • LogP   1.0234
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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