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CS-W001157 4
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2-Hydroxy-3,3-dimethylbutanoic acid

  • CAS No. 4026-20-4

  • Cat. No. CS-0378432
  • Purity≥97%
  • MDL No.MFCD00029993

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

2-Hydroxy-3,3-dimethylbutanoic acid|CS-0378432

Structure of 4026-20-4

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General Information

  • CAS No. 4026-20-4
  • Cat. No. CS-0378432
  • Purity ≥97%
  • MDL No. MFCD00029993
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂O₃
  • Molecular Weight 132.16
  • Synonym(s) Trimethyllactic acid
  • SMILES CC(C)(C)C(O)C(O)=O

Synthesis

  • Route1

    References

    • Nitsch, Dominik; Huber, Stefan M.; Poethig, Alexander; Narayanan, Arjun; Olah, George A.; Prakash, G. K. Surya; Bach, Thorsten Journal of the American Chemical Society, 2014 , vol. 136, # 7 p. 2851 - 2857
  • Route2

    References

    • Robertson, Jeremy; Hall, Michael J.; Green, Stuart P. Tetrahedron, 2009 , vol. 65, # 28 p. 5541 - 5551
  • Route3
    • 3,3-Dimethyl-1,2-butanediol|CS-0181444
      59562-82-2
    • ~46%
    • In-stock
      2-Hydroxy-3,3-dimethylbutanoic acid|CS-0378432
      4026-20-4

    References

    • Tuck, Kellie L.; Saldanha, S. Adrian; Birch, Louise M.; Smith, Alison G.; Abell, Chris Organic and Biomolecular Chemistry, 2006 , vol. 4, # 19 p. 3598 - 3610

Safety Information

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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   57.53
  • LogP   0.478
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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