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CS-W001157 4
Total: USD 88.00

Isopropyl 4-oxopentanoate

  • CAS No. 21884-26-4

  • Cat. No. CS-0449980
  • Purity≥98%
  • MDL No.None

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

Isopropyl 4-oxopentanoate|CS-0449980

Structure of 21884-26-4

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General Information

  • CAS No. 21884-26-4
  • Cat. No. CS-0449980
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O₃
  • Molecular Weight 158.19
  • Synonym(s) propan-2-yl 4-oxopentanoate
  • SMILES CC(C)OC(=O)CCC(=O)C

Synthesis

  • Route1
    • null|null
      98-00-0
    • null|null
      67-63-0
    • ~88%
    • Isopropyl 4-oxopentanoate|CS-0449980
      21884-26-4

    References

    • Wang, Guofeng; Zhang, Zhanquan; Song, Linhua Green Chemistry, 2014 , vol. 16, # 3 p. 1436 - 1443
  • Route2

    References

    • Drefahl; Gross Journal fuer Praktische Chemie (Leipzig), 1955 , vol. <4> 1, p. 153,154
  • Route3
    • Topiramate EP Impurity E|CS-1659375
      6347-01-9
    • null|null
      67-63-0
    • ~13%
    • 5-(Isopropoxymethyl)furan-2-carbaldehyde|CS-0456422
      85733-99-9
    • Isopropyl 4-oxopentanoate|CS-0449980
      21884-26-4

    References

    • Kuo, Chung-Hao; Poyraz, Altug S.; Jin, Lei; Meng, Yongtao; Pahalagedara, Lakshitha; Chen, Sheng-Yu; Kriz, David A.; Guild, Curtis; Gudz, Anton; Suib, Steven L. Green Chemistry, 2014 , vol. 16, # 2 p. 785 - 791

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   1.3072
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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