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CS-W001157 4
Total: USD 88.00

2-((4-Methoxyphenyl)amino)-2-thioxoacetic acid

  • CAS No. 946-61-2

  • Cat. No. CS-0587419
  • Purity≥98%
  • MDL No.None

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

2-((4-Methoxyphenyl)amino)-2-thioxoacetic acid|CS-0587419

Structure of 946-61-2

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General Information

  • CAS No. 946-61-2
  • Cat. No. CS-0587419
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₃S
  • Molecular Weight 211.24
  • Synonym(s) 2-(4-methoxyphenylamino)-2-thioxoacetic acid
  • SMILES COC1=CC=C(C=C1)NC(=S)C(=O)O

Synthesis

  • Route1

    References

    • Yarovenko, V. N.; Stoyanovich, F. M.; Zolotarskaya, O. Yu.; Chernoburova, E. I.; Zararzin, I. V.; Krayushkin, M. M. Russian Chemical Bulletin, 2002 , vol. 51, # 1 p. 144 - 147 Izvestiya Akademi Nauk, Seriya Khimicheskaya, 2002 , # 1 p. 136 - 138
  • Route2

    References

    • Yarovenko, V. N.; Stoyanovich, F. M.; Zolotarskaya, O. Yu.; Chernoburova, E. I.; Zararzin, I. V.; Krayushkin, M. M. Russian Chemical Bulletin, 2002 , vol. 51, # 1 p. 144 - 147 Izvestiya Akademi Nauk, Seriya Khimicheskaya, 2002 , # 1 p. 136 - 138
  • Route3
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    • ~%
    • 2-((4-Methoxyphenyl)amino)-2-thioxoacetic acid|CS-0587419
      946-61-2

    References

    • Meroni, Giuseppe; Ciana, Paolo; Maggi, Adriana; Santaniello, Enzo Synlett, 2009 , # 16 p. 2682 - 2684

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   58.56
  • LogP   1.5191
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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