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CS-W001157 4
Total: USD 88.00

P-Toluenesulfonic Acid (3S,5R)-5-(2,4-Difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-ylmethyl Ester

  • CAS No. 149809-43-8

  • Cat. No. CS-M2899
  • Purity≥98%
  • MDL No.MFCD13195567

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

P-Toluenesulfonic Acid (3S,5R)-5-(2,4-Difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-ylmethyl Ester|CS-M2899

Structure of 149809-43-8

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General Information

  • CAS No. 149809-43-8
  • Cat. No. CS-M2899
  • Purity ≥98%
  • MDL No. MFCD13195567
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₁H₂₁F₂N₃O₄S
  • Molecular Weight 449.47
  • Synonym(s) None
  • SMILES O=S(OC[C@H](CO1)C[C@@]1(C2=CC=C(F)C=C2F)CN3C=NC=N3)(C4=CC=C(C)C=C4)=O

Synthesis

  • Route1
    • null|null
      98-59-9
    • In-stock
      Posaconazole impurity 4|CS-0010881
      160709-02-4
    • ~91%
    • In-stock
      P-Toluenesulfonic Acid (3S,5R)-5-(2,4-Difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-ylmethyl Ester|CS-M2899
      149809-43-8

    References

    • Lovey, Raymond G.; Saksena, Anil K.; Girijavallabhan, Viyyoor M. Tetrahedron Letters, 1994 , vol. 35, # 33 p. 6047 - 6050
  • Route2
    • null|null
      182009-37-6
    • ~%
    • In-stock
      P-Toluenesulfonic Acid (3S,5R)-5-(2,4-Difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-ylmethyl Ester|CS-M2899
      149809-43-8

    References

    • Tetrahedron Letters, , vol. 37, # 32 p. 5657 - 5660
  • Route3
    • Benzenebutanol, 2,4-difluoro-δ-methylene-β-[(phenylmethoxy)methyl]-, (S)-|CS-1001900
      165115-78-6
    • ~%
    • In-stock
      P-Toluenesulfonic Acid (3S,5R)-5-(2,4-Difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-ylmethyl Ester|CS-M2899
      149809-43-8

    References

    • Tetrahedron Letters, , vol. 37, # 32 p. 5657 - 5660

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331-H341
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   83.31
  • LogP   3.20222
  • H_Acceptors   7
  • H_Donors   0
  • Rotatable_Bonds   7

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