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CS-W001157 4
Total: USD 88.00

4-Methoxy-3-nitrobenzothioamide

  • CAS No. 175277-84-6

  • Cat. No. CS-0355732
  • Molecule weight212.23
  • Purity≥98%
  • MDL No.None

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

4-Methoxy-3-nitrobenzothioamide|CS-0355732

Structure of 175277-84-6

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General Information

  • CAS No. 175277-84-6
  • Cat. No. CS-0355732
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₂O₃S
  • Molecular Weight 212.23
  • Synonym(s) 4-Methoxy-3-nitrobenzenecarbothioamide
  • SMILES S=C(C1=CC=C(OC)C([N+]([O-])=O)=C1)N

Synthesis

  • Route1
    • 4-Methoxy-3-nitrobenzamide|CS-0198843
      10397-58-7
    • ~75%
    • 4-Methoxy-3-nitrobenzothioamide|CS-0355732
      175277-84-6

    References

    • Dynamix Pharmaceuticals LTD. Patent: US2012/316148 A1, 2012 ; Location in patent: Page/Page column 193; 194; 195 ; US 20120316148 A1

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   78.39
  • LogP   1.2376
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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