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CS-W001157 4
Total: USD 88.00

2-Acetoxyacetic acid

  • CAS No. 13831-30-6

  • Cat. No. CS-0155005
  • Purity≥96%
  • MDL No.MFCD00011551

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

2-Acetoxyacetic acid|CS-0155005

Structure of 13831-30-6

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General Information

  • CAS No. 13831-30-6
  • Cat. No. CS-0155005
  • Purity ≥96%
  • MDL No. MFCD00011551
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₆O₄
  • Molecular Weight 118.09
  • Synonym(s) None
  • SMILES O=C(O)COC(=O)C

Description

Acetoxyacetic acid is kinetically stable degradation product of oxidative degradation of 1,3-dialkylimidazolium ionic liquids in hydrogen peroxide/aceticacid aqueous medium assisted by ultrasonic chemical irradiation. It is an intermediate formed during reactions of manganic acetate in glacial acetic acid with benzene (100C), chlorobenzene, or toluene.Acetoxyacetic acid was used in preparation of tert-butyl glycolate.

Synthesis

  • Route1
    • In-stock
      Glycolic acid|CS-W016683
      79-14-1
    • null|null
      75-36-5
    • ~99%
    • In-stock
      2-Acetoxyacetic acid|CS-0155005
      13831-30-6

    References

    • Athanasellis, Giorgos; Detsi, Anastasia; Prousis, Kyriakos; Igglessi-Markopoulou, Olga; Markopoulos, John Synthesis, 2003 , # 13 p. 2015 - 2022
  • Route2

    References

    • Yang, Dan; Chen, Fei; Dong, Ze-Min; Zhang, Dan-Wei Journal of Organic Chemistry, 2004 , vol. 69, # 6 p. 2221 - 2223
  • Route3
    • null|null
      30379-73-8
    • ~%
    • In-stock
      2-Acetoxyacetic acid|CS-0155005
      13831-30-6

    References

    • Bulletin de la Societe Chimique de France, , p. 4018 - 4023

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.6
  • LogP   -0.3659
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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