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CS-W001157 4
Total: USD 88.00

2-((2-Chloro-4-nitrophenyl)thio)acetic acid

  • CAS No. 30880-64-9

  • Cat. No. CS-0327970
  • Molecule weight247.66
  • Purity95+%
  • MDL No.None

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

2-((2-Chloro-4-nitrophenyl)thio)acetic acid|CS-0327970

Structure of 30880-64-9

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General Information

  • CAS No. 30880-64-9
  • Cat. No. CS-0327970
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆ClNO₄S
  • Molecular Weight 247.66
  • Synonym(s) 2-[(2-Chloro-4-nitrophenyl)sulfanyl]acetic acid
  • SMILES C1=CC(=C(C=C1[N+](=O)[O-])Cl)SCC(=O)O

Synthesis

  • Route1
    • null|null
      99-54-7
    • null|null
      68-11-1
    • ~99%
    • 2-((2-Chloro-4-nitrophenyl)thio)acetic acid|CS-0327970
      30880-64-9

    References

    • Xu, Zhenyuan; Du, Xiaohua; Gu, Jianbo Organic Preparations and Procedures International, 2003 , vol. 35, # 4 p. 439 - 443
  • Route2
    • null|null
      30880-65-0
    • ~%
    • 2-((2-Chloro-4-nitrophenyl)thio)acetic acid|CS-0327970
      30880-64-9

    References

    • Journal of Medicinal Chemistry, , vol. 13, p. 1165 - 1170
  • Route3
    • null|null
      99-54-7
    • ~%
    • 2-((2-Chloro-4-nitrophenyl)thio)acetic acid|CS-0327970
      30880-64-9

    References

    • Journal of Medicinal Chemistry, , vol. 13, p. 1165 - 1170

Safety Information

Download SDS
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   80.44
  • LogP   2.4249
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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