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Ethyl 5-methoxy-3-oxopentanoate

  • CAS No. 104629-86-9

  • Cat. No. CS-0440460
  • Purity≥97%
  • MDL No.MFCD03844433

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

Ethyl 5-methoxy-3-oxopentanoate|CS-0440460

Structure of 104629-86-9

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General Information

  • CAS No. 104629-86-9
  • Cat. No. CS-0440460
  • Purity ≥97%
  • MDL No. MFCD03844433
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O₄
  • Molecular Weight 174.19
  • Synonym(s) Ethyl5-methoxy-3-oxopentanoate
  • SMILES CCOC(=O)CC(=O)CCOC

Synthesis

  • Route1

    References

    • ASTRAZENECA AB; ASTRAZENECA UK LIMITED; BENGTSSON, Boel, Ase; BLACKABY, Wesley; CUMMING, John; FAULL, Alan, Wellington; LARSSON, Joakim; NASH, Ian, Alun; OLDHAM, Keith; PAPE, Andrew Patent: WO2011/114148 A1, 2011 ; Location in patent: Page/Page column 93 ; WO 2011/114148 A1
  • Route2

    References

    • Cytopharm, Inc. Patent: US5179120 A1, 1993 ;

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   0.5452
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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