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CS-W001157 4
Total: USD 88.00

Hexyl methanesulfonate

  • CAS No. 16156-50-6

  • Cat. No. CS-0099480
  • Purity≥97%
  • MDL No.MFCD00674707

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

Hexyl methanesulfonate|CS-0099480

Structure of 16156-50-6

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General Information

  • CAS No. 16156-50-6
  • Cat. No. CS-0099480
  • Purity ≥97%
  • MDL No. MFCD00674707
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₆O₃S
  • Molecular Weight 180.27
  • Synonym(s) Methanesulfonic acid hexyl ester
  • SMILES CS(=O)(OCCCCCC)=O

Description

2-Methyl-6-(trifluoromethyl)nicotinic acid is used as a pharmaceutical intermediate.

Synthesis

  • Route1
    • null|null
      124-63-0
    • In-stock
      1-Hexanol|CS-0076046
      111-27-3
    • ~99%
    • In-stock
      Hexyl methanesulfonate|CS-0099480
      16156-50-6

    References

    • Robinson, Philip L.; Barry, Carey N.; Kelly, Jeffery W.; Evans, Slayton A. Journal of the American Chemical Society, 1985 , vol. 107, # 18 p. 5210 - 5219
  • Route2

    References

    • Journal of Organic Chemistry, , vol. 50, # 11 p. 1872 - 1876

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   43.37
  • LogP   1.5429
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   6

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