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CS-W001157 4
Total: USD 88.00

(S)-2,4-Dihydroxy-3,3-dimethylbutanoic acid

  • CAS No. 1112-32-9

  • Cat. No. CS-0527781
  • Purity≥98%
  • MDL No.None

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

(S)-2,4-Dihydroxy-3,3-dimethylbutanoic acid|CS-0527781

Structure of 1112-32-9

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General Information

  • CAS No. 1112-32-9
  • Cat. No. CS-0527781
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂O₄
  • Molecular Weight 148.16
  • Synonym(s) (2S)-2,4-dihydroxy-3,3-dimethylbutanoic acid
  • SMILES O=C(O)[C@@H](O)C(C)(C)CO

Synthesis

  • Route1
    • null|null
      470-29-1
    • ~%
    • (S)-2,4-Dihydroxy-3,3-dimethylbutanoic acid|CS-0527781
      1112-32-9

    References

    • Stiller et al. Journal of the American Chemical Society, 1940 , vol. 62, p. 1788 Full Text Show Details Kuhn; Wieland Chemische Berichte, 1940 , vol. 73, p. 974
  • Route2

    References

    • Liu, Andrew Man Fai; Somers, Neil A.; Kazlauskas, Romas J.; Brush, Terry S.; Zocher, Frank; Enzelberger, Markus M.; Bornscheuer, Uwe T.; Horsman, Geoff P.; Mezzetti, Alessandra; Schmidt-Dannert, Claudia; Schmid, Rolf D. Tetrahedron Asymmetry, 2001 , vol. 12, # 4 p. 545 - 556
  • Route3

    References

    • Kesseler, Maria; Friedrich, Thomas; Hoeffken, Hans Wolfgang; Hauer, Bernhard Advanced Synthesis and Catalysis, 2002 , vol. 344, # 10 p. 1103 - 1110

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   77.76
  • LogP   -0.5496
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   3

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