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(S)-tert-butyl 6-chloro-5-hydroxy-3-oxohexanoate Rosuvastatin Impurity

  • CAS No. 154026-92-3

  • Cat. No. CS-0165317
  • Purity≥97%
  • MDL No.MFCD02093052

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

(S)-tert-butyl 6-chloro-5-hydroxy-3-oxohexanoate  Rosuvastatin Impurity|CS-0165317

Structure of 154026-92-3

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General Information

  • CAS No. 154026-92-3
  • Cat. No. CS-0165317
  • Purity ≥97%
  • MDL No. MFCD02093052
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₇ClO₄
  • Molecular Weight 236.69
  • Synonym(s) tert-butyl (5S)-6-chloro-5-hydroxy-3-oxohexanoate
  • SMILES O=C(OC(C)(C)C)CC(C[C@H](O)CCl)=O

Synthesis

  • Route1
    • null|null
      540-88-5
    • Ethyl 4-chloro-3-hydroxybutanoate|CS-0187412
      10488-69-4
    • ~77%
    • (S)-tert-butyl 6-chloro-5-hydroxy-3-oxohexanoate  Rosuvastatin Impurity|CS-0165317
      154026-92-3

    References

    • Kaneka Corporation Patent: US6340767 B1, 2002 ; Location in patent: Example 5 ;
  • Route2
    • null|null
      276249-18-4
    • ~70%
    • (S)-tert-butyl 6-chloro-5-hydroxy-3-oxohexanoate  Rosuvastatin Impurity|CS-0165317
      154026-92-3

    References

    • Wolberg, Michael; Hummel, Werner; Wandrey, Christian; Mueller, Michael Angewandte Chemie - International Edition, 2000 , vol. 39, # 23 p. 4306 - 4308
  • Route3

    References

    • Wolberg, Michael; Hummel, Werner; Mueller, Michael Chemistry - A European Journal, 2001 , vol. 7, # 21 p. 4562 - 4571

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08
Signal Word : Danger
UN#: 2810
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+P364-P405-P501

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   1.2771
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   5

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