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CS-W001157 4
Total: USD 88.00

Butyl benzenesulfonate

  • CAS No. 80-44-4

  • Cat. No. CS-W014927
  • Purity≥95%
  • MDL No.MFCD00025036

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

Butyl benzenesulfonate|CS-W014927

Structure of 80-44-4

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General Information

  • CAS No. 80-44-4
  • Cat. No. CS-W014927
  • Purity ≥95%
  • MDL No. MFCD00025036
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₄O₃S
  • Molecular Weight 214.28
  • Synonym(s) N-BUTYL BENZENESULFONATE
  • SMILES O=S(C1=CC=CC=C1)(OCCCC)=O

Synthesis

  • Route1
    • null|null
      98-09-9
    • null|null
      71-36-3
    • ~93%
    • Butyl benzenesulfonate|CS-W014927
      80-44-4

    References

    • Tamaddon, Fatemeh; Sabeti, Mohammad Reza; Jafari, Abbas Ali; Tirgir, Farhang; Keshavarz, Elham Journal of Molecular Catalysis A: Chemical, 2011 , vol. 351, p. 41 - 45
  • Route2
    • null|null
      174741-00-5
    • ~%
    • Butyl benzenesulfonate|CS-W014927
      80-44-4

    References

    • Journal of Organic Chemistry, , vol. 61, # 4 p. 1392 - 1398
  • Route3
    • N-methyl-N-phenylbenzenesulfonamide|CS-0368168
      90-10-8
    • ~%
    • Butyl benzenesulfonate|CS-W014927
      80-44-4
    • null|null
      53973-76-5

    References

    • Journal of Organic Chemistry, , vol. 61, # 4 p. 1392 - 1398

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.192
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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