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CS-W001157 4
Total: USD 88.00

Diethyl 2-isopentylmalonate

  • CAS No. 5398-08-3

  • Cat. No. CS-0361267
  • Purity≥96%
  • MDL No.None

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

Diethyl 2-isopentylmalonate|CS-0361267

Structure of 5398-08-3

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General Information

  • CAS No. 5398-08-3
  • Cat. No. CS-0361267
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂O₄
  • Molecular Weight 230.30
  • Synonym(s) Diethyl isopentylmalonate
  • SMILES CCOC(=O)C(CCC(C)C)C(=O)OCC

Synthesis

  • Route1
    • null|null
      107-82-4
    • null|null
      105-53-3
    • ~84%
    • In-stock
      Diethyl 2-isopentylmalonate|CS-0361267
      5398-08-3

    References

    • Kryshtal; Zhdankina; Konoplyannikov; Tartakovsky; Serebryakov; Smirnov; Konoplyannikova; Agaeva; Zlotina Russian Chemical Bulletin, 2012 , vol. 61, # 2 p. 253 - 258 Izv. Akad. Nauk, Ser. Khim., 2012 , vol. 61, # 2 p. 253 - 258
  • Route2
    • 1,3-Diethyl 2-(3-methylbut-2-en-1-yl)propanedioate|CS-0210454
      22539-80-6
    • ~50%
    • In-stock
      Diethyl 2-isopentylmalonate|CS-0361267
      5398-08-3

    References

    • Kar, Paramita; Rao; Nagaiah; Gurjar Journal of the Indian Chemical Society, 2005 , vol. 82, # 1 p. 52 - 54
  • Route3
    • Ethyl 5-methylhexanoate|CS-0257454
      10236-10-9
    • null|null
      105-58-8
    • ~%
    • In-stock
      Diethyl 2-isopentylmalonate|CS-0361267
      5398-08-3
    • Diethyl 2-ethyl-2-isopentylmalonate|CS-0671687
      77-24-7

    References

    • Journal of the American Chemical Society, , vol. 64, p. 579 US2376837 , ; US2454360 , ; US2367632 , ; Journal of the American Chemical Society, , vol. 63, p. 2056,2058

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   52.6
  • LogP   2.165
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   7

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