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CS-W001157 4
Total: USD 88.00

Ethyl 2-((4-chlorophenyl)thio)acetate

  • CAS No. 52377-68-1

  • Cat. No. CS-0315874
  • Purity≥97%
  • MDL No.None

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

Ethyl 2-((4-chlorophenyl)thio)acetate|CS-0315874

Structure of 52377-68-1

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General Information

  • CAS No. 52377-68-1
  • Cat. No. CS-0315874
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁ClO₂S
  • Molecular Weight 230.71
  • Synonym(s) ETHYL 2-[(4-CHLOROPHENYL)THIO]ACETATE
  • SMILES CCOC(=O)CSC1=CC=C(C=C1)Cl

Synthesis

  • Route1
    • null|null
      623-73-4
    • null|null
      106-54-7
    • ~90%
    • Ethyl 2-((4-chlorophenyl)thio)acetate|CS-0315874
      52377-68-1

    References

    • Zhu, Zuolin; Espenson, James H. Journal of the American Chemical Society, 1996 , vol. 118, # 41 p. 9901 - 9907
  • Route2
    • null|null
      106-54-7
    • null|null
      623-48-3
    • ~71%
    • Ethyl 2-((4-chlorophenyl)thio)acetate|CS-0315874
      52377-68-1

    References

    • Nittoli, Thomas; Curran, Kevin; Insaf, Shabana; DiGrandi, Martin; Orlowski, Mark; Chopra, Rajiv; Agarwal, Atul; Howe, Anita Y. M.; Prashad, Amar; Floyd, M. Brawner; Johnson, Bernard; Sutherland, Alan; Wheless, Karen; Feld, Boris; O'Connell, John; Mansour, Tarek S.; Bloom, Jonathan Journal of Medicinal Chemistry, 2007 , vol. 50, # 9 p. 2108 - 2116
  • Route3
    • null|null
      75141-99-0
    • null|null
      105-53-3
    • ~71%
    • null|null
      39133-62-5
    • Ethyl 2-((4-chlorophenyl)thio)acetate|CS-0315874
      52377-68-1
    • null|null
      76000-59-4

    References

    • Shinhama, Koichi; Kim, Yong Hae; Oae, Shigeru Bulletin of the Chemical Society of Japan, 1980 , vol. 53, # 6 p. 1771 - 1772

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   26.3
  • LogP   2.9952
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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