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CS-W001157 4
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Methyl 2-thioxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate

  • CAS No. 64375-41-3

  • Cat. No. CS-0187480
  • Purity≥98%
  • MDL No.None

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

Methyl 2-thioxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate|CS-0187480

Structure of 64375-41-3

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General Information

  • CAS No. 64375-41-3
  • Cat. No. CS-0187480
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂S
  • Molecular Weight 208.24
  • Synonym(s) Methyl 2-sulfanylidene-1,3-dihydro-1,3-benzodiazole-5-carboxylate
  • SMILES O=C(OC)C1=CC=C2NC(=S)NC2=C1

Synthesis

  • Route1
    • null|null
      75-15-0
    • In-stock
      Methyl 3,4-diaminobenzoate|CS-W007431
      36692-49-6
    • ~%
    • In-stock
      Methyl 2-thioxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate|CS-0187480
      64375-41-3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 14 p. 4221 - 4224
  • Route2
    • null|null
      6313-39-9
    • ~%
    • In-stock
      Methyl 2-thioxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate|CS-0187480
      64375-41-3

    References

    • Chemical & Pharmaceutical Bulletin, , vol. 30, # 8 p. 2714 - 2722
  • Route3
    • null|null
      75-15-0
    • null|null
      84445-93-2
    • ~30%
    • In-stock
      Methyl 2-thioxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate|CS-0187480
      64375-41-3
    • null|null
      84445-87-4

    References

    • Chemical & Pharmaceutical Bulletin, , vol. 30, # 8 p. 2714 - 2722

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   57.88
  • LogP   2.01209
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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