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CS-W001157 4
Total: USD 88.00

2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid

  • CAS No. 65051-31-2

  • Cat. No. CS-0251328
  • Purity≥95%
  • MDL No.None

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

2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid|CS-0251328

Structure of 65051-31-2

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General Information

  • CAS No. 65051-31-2
  • Cat. No. CS-0251328
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈Cl₂O₂S
  • Molecular Weight 251.13
  • Synonym(s) 2,4-Dichlorobenzylthio-acetic acid
  • SMILES C1=CC(=CC(=C1CSCC(=O)O)Cl)Cl

Synthesis

  • Route1
    • null|null
      3926-62-3
    • null|null
      94-99-5
    • ~84%
    • 2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid|CS-0251328
      65051-31-2

    References

    • Laboratoire L. Lafon Patent: US4122186 A1, 1978 ;
  • Route2
    • null|null
      124-41-4
    • ~%
    • 2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid|CS-0251328
      65051-31-2

    References

    • Newman; Fones; Renoll Journal of the American Chemical Society, 1947 , vol. 69, p. 718,721
  • Route3
    • null|null
      94-99-5
    • null|null
      79-11-8
    • ~%
    • 2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid|CS-0251328
      65051-31-2

    References

    • Lab. Lafon Patent: DE2711451 , 1977 ; Chem.Abstr., 1978 , vol. 88, # 22917

Safety Information

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

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.3112
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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