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CS-W001157 4
Total: USD 88.00

6-Methoxybenzo[d]thiazole-2-carboxylic acid

  • CAS No. 946-13-4

  • Cat. No. CS-0067221
  • Purity≥97%
  • MDL No.MFCD01119043

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

6-Methoxybenzo[d]thiazole-2-carboxylic acid|CS-0067221

Structure of 946-13-4

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General Information

  • CAS No. 946-13-4
  • Cat. No. CS-0067221
  • Purity ≥97%
  • MDL No. MFCD01119043
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₃S
  • Molecular Weight 209.22
  • Synonym(s) 6-Methoxybenzothiazole-2-carboxylic acid
  • SMILES COC1=CC2=C(C=C1)N=C(C(O)=O)S2

Synthesis

  • Route1

    References

    • Organic Letters, , vol. 14, # 15 p. 3986 - 3989
  • Route2
    • 2-((4-Methoxyphenyl)amino)-2-thioxoacetic acid|CS-0587419
      946-61-2
    • ~50%
    • 6-Methoxybenzo[d]thiazole-2-carboxylic acid|CS-0067221
      946-13-4

    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
    • 6-Methoxybenzo[d]thiazole-2-carboxamide|CS-0330095
      946-12-3
    • ~77%
    • 6-Methoxybenzo[d]thiazole-2-carboxylic acid|CS-0067221
      946-13-4

    References

    • Krayushkin; Stoyanovich; Zolotarskaya; Chernoburova; Makhova; Yarovenko; Zavarzin; Martynkin; Uzhinov Chemistry of Heterocyclic Compounds, 2002 , vol. 38, # 2 p. 165 - 176

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   59.42
  • LogP   2.0031
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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