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CS-W001157 4
Total: USD 88.00

Atorvastatin acetonide

  • CAS No. 581772-29-4

  • Cat. No. CS-0112185
  • Molecule weight598.70
  • Purity≥98%
  • MDL No.None

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

Atorvastatin acetonide|CS-0112185

Structure of 581772-29-4

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General Information

  • CAS No. 581772-29-4
  • Cat. No. CS-0112185
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₆H₃₉FN₂O₅
  • Molecular Weight 598.70
  • Synonym(s) None
  • SMILES O=C(O)C[C@@H]1OC(C)(C)O[C@H](CCN2C(C3=CC=C(F)C=C3)=C(C4=CC=CC=C4)C(C(NC5=CC=CC=C5)=O)=C2C(C)C)C1

Synthesis

  • Route1
    • methyl 2-((4R,6R)-6-(2-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4- (phenylcarbamoyl)-1H-pyrrol-1-yl)ethyl)-2,2-dimethyl-1,3-dioxan-4- yl)acetate|CS-0914014
      1353049-81-6
    • ~97%
    • Atorvastatin acetonide|CS-0112185
      581772-29-4

    References

    • NICOX S.A.; STORONI, Laura; BONFANTI, Annalisa; BENEDINI, Francesca; OLIVA, Francesca; MIGLIETTA, Daniela; ONGINI, Ennio Patent: WO2011/160974 A2, 2011 ; Location in patent: Page/Page column 28 ;
  • Route2

    References

    • PIRAMAL LIFE SCIENCES LIMITED Patent: US2011/263526 A1, 2011 ; Location in patent: Page/Page column 80 ;
  • Route3

    References

    • NICOX S.A.; STORONI, Laura; BONFANTI, Annalisa; BENEDINI, Francesca; OLIVA, Francesca; MIGLIETTA, Daniela; ONGINI, Ennio Patent: WO2011/160974 A2, 2011 ;

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   89.79
  • LogP   8.1119
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   10

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