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CS-W001157 4
Total: USD 88.00

2-Hydroxyethyl isobutyrate

  • CAS No. 6942-58-1

  • Cat. No. CS-0608394
  • Purity≥95%
  • MDL No.None

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

2-Hydroxyethyl isobutyrate|CS-0608394

Structure of 6942-58-1

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General Information

  • CAS No. 6942-58-1
  • Cat. No. CS-0608394
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂O₃
  • Molecular Weight 132.16
  • Synonym(s) Propanoic acid, 2-methyl-, 2-hydroxyethyl ester
  • SMILES CC(C)C(OCCO)=O

Synthesis

  • Route1

    References

    • Imada, Yasushi; Iida, Hiroki; Kitagawa, Takahiro; Naota, Takeshi Chemistry - A European Journal, 2011 , vol. 17, # 21 p. 5908 - 5920
  • Route2
    • In-stock
      Ethylene glycol,98%|CS-0015059
      107-21-1
    • null|null
      79-30-1
    • ~27%
    • In-stock
      2-Hydroxyethyl isobutyrate|CS-0608394
      6942-58-1

    References

    • Zakhari, Joseph S.; Kinoyama, Isao; Hixon, Mark S.; Di Mola, Antonia; Globisch, Daniel; Janda, Kim D. Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 21 p. 6203 - 6209
  • Route3
    • In-stock
      Ethylene glycol,98%|CS-0015059
      107-21-1
    • null|null
      79-31-2
    • ~77%
    • In-stock
      2-Hydroxyethyl isobutyrate|CS-0608394
      6942-58-1

    References

    • REVIVA PHARMACEUTICALS, INC. Patent: US2012/172426 A1, 2012 ; Location in patent: Page/Page column 28 ;

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   46.53
  • LogP   0.1779
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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