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CS-W001157 4
Total: USD 88.00

Isopropyl 3-bromo-2-oxopropanoate

  • CAS No. 56417-63-1

  • Cat. No. CS-M0667
  • Purity≥95%
  • MDL No.MFCD18642772

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

Isopropyl 3-bromo-2-oxopropanoate|CS-M0667

Structure of 56417-63-1

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General Information

  • CAS No. 56417-63-1
  • Cat. No. CS-M0667
  • Purity ≥95%
  • MDL No. MFCD18642772
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₉BrO₃
  • Molecular Weight 209.04
  • Synonym(s) Propanoic acid, 3-bromo-2-oxo-, 1-methylethyl ester
  • SMILES O=C(OC(C)C)C(CBr)=O

Synthesis

  • Route1
    • null|null
      67-63-0
    • null|null
      75261-25-5
    • ~%
    • Isopropyl 3-bromo-2-oxopropanoate|CS-M0667
      56417-63-1

    References

    • EXELIXIS, INC. Patent: WO2007/70796 A1, 2007 ; Location in patent: Page/Page column 120 ; WO 2007/070796 A1
  • Route2
    • In-stock
      3-Bromopyruvic acid|CS-5517
      1113-59-3
    • null|null
      67-63-0
    • ~%
    • Isopropyl 3-bromo-2-oxopropanoate|CS-M0667
      56417-63-1
    • null|null
      942148-14-3

    References

    • EXELIXIS, INC. Patent: WO2007/70796 A1, 2007 ; Location in patent: Page/Page column 110; 118-119 ; WO 2007/070796 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   0.902
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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