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CS-W001157 4
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Methyl (3r)-4-chloro-3-hydroxybutanoate

  • CAS No. 88496-70-2

  • Cat. No. CS-0259583
  • Purity≥95%
  • MDL No.None

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

Methyl (3r)-4-chloro-3-hydroxybutanoate|CS-0259583

Structure of 88496-70-2

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General Information

  • CAS No. 88496-70-2
  • Cat. No. CS-0259583
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₉ClO₃
  • Molecular Weight 152.58
  • Synonym(s) R-Methyl-4-Chloro-3-Hydroxy Butyrate
  • SMILES COC(=O)C[C@H](CCl)O

Synthesis

  • Route1

    References

    • Ushio, Kazutoshi; Inouye, Kiyoko; Nakamura, Kaoru; Oka, Shinzaburo; Ohno, Atsuyoshi Tetrahedron Letters, 1986 , vol. 27, # 23 p. 2657 - 2660
  • Route2
    • null|null
      114819-45-3
    • ~26%
    • In-stock
      Methyl (3r)-4-chloro-3-hydroxybutanoate|CS-0259583
      88496-70-2

    References

    • VERTEX PHARMACEUTICALS INCORPORATED Patent: WO2007/21982 A2, 2007 ; Location in patent: Page/Page column 67-68 ;
  • Route3

    References

    • Bizerra, Ayla M.C.; Gonzalo, Gonzalo de; Lavandera, Ivan; Gotor-Fernandez, Vicente; de Mattos, Marcos Carlos; de Oliveira, Maria da Conceicao F.; Lemos, Telma L.G.; Gotor, Vicente Tetrahedron Asymmetry, 2010 , vol. 21, # 5 p. 566 - 570

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1760
Class : 8
Packing Group : Ⅲ
Hazard Statements : H318
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   0.1492
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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