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CS-W001157 4
Total: USD 88.00

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

  • CAS No. 3507-18-4

  • Cat. No. CS-0187967
  • Molecule weight193.22
  • Purity≥95%
  • MDL No.None

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

6-Methylbenzo[d]thiazole-2-carboxylic acid|CS-0187967

Structure of 3507-18-4

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General Information

  • CAS No. 3507-18-4
  • Cat. No. CS-0187967
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₂S
  • Molecular Weight 193.22
  • Synonym(s) 6-Methyl-2-benzothiazolecarboxylic acid
  • SMILES CC1=CC2=C(C=C1)N=C(C(=O)O)S2

Synthesis

  • Route1

    References

    • Inomata, Hiroshi; Ogata, Kenichi; Fukuzawa, Shin-Ichi; Hou, Zhaomin Organic Letters, 2012 , vol. 14, # 15 p. 3986 - 3989
  • Route2
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      90563-87-4
    • ~%
    • 6-Methylbenzo[d]thiazole-2-carboxylic acid|CS-0187967
      3507-18-4

    References

    • Mills; Braunholtz Journal of the Chemical Society, 1922 , vol. 121, p. 1493
  • Route3

    References

    • Mills; Braunholtz Journal of the Chemical Society, 1922 , vol. 121, p. 1493

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   50.19
  • LogP   2.30292
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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