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2-(tert-Butoxy)-2-oxoethyl 2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetate Acemetacin Impurity

  • CAS No. 75302-98-6

  • Cat. No. CS-0531435
  • Molecule weight471.93
  • Purity≥98%
  • MDL No.None

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

2-(tert-Butoxy)-2-oxoethyl 2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetate Acemetacin Impurity|CS-0531435

Structure of 75302-98-6

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General Information

  • CAS No. 75302-98-6
  • Cat. No. CS-0531435
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₅H₂₆ClNO₆
  • Molecular Weight 471.93
  • Synonym(s) 2-tert-Butoxy-2-oxoethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate
  • SMILES O=C(CC1=C(C)N(C(C2=CC=C(C=C2)Cl)=O)C3=C1C=C(C=C3)OC)OCC(OC(C)(C)C)=O

Synthesis

  • Route1

    References

    • NitroMed, Inc. Patent: US2004/24057 A1, 2004 ; Location in patent: Page/Page column 52 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H300-H413
Precautionary Statements : P264-P270-P273-P330-P405-P501

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Computational Chemistry Data

  • TPSA   83.83
  • LogP   4.72762
  • H_Acceptors   7
  • H_Donors   0
  • Rotatable_Bonds   6

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