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CS-W001157 4
Total: USD 88.00

3-Methylbenzo[d]thiazol-3-ium iodide

  • CAS No. 2786-31-4

  • Cat. No. CS-0112720
  • Purity≥98%
  • MDL No.MFCD00050297

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

3-Methylbenzo[d]thiazol-3-ium iodide|CS-0112720

Structure of 2786-31-4

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General Information

  • CAS No. 2786-31-4
  • Cat. No. CS-0112720
  • Purity ≥98%
  • MDL No. MFCD00050297
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈INS
  • Molecular Weight 277.13
  • Synonym(s) 3-Methylbenzothiazolium iodide
  • SMILES C[N+]1=CSC2=CC=CC=C12.[I-]

Synthesis

  • Route1
    • Benzothiazole, ≥96%|CS-1269066
      95-16-9
    • null|null
      74-88-4
    • ~98%
    • In-stock
      3-Methylbenzo[d]thiazol-3-ium iodide|CS-0112720
      2786-31-4

    References

    • Chen, Yao-Tsung; Jordan, Frank Journal of Organic Chemistry, 1991 , vol. 56, # 17 p. 5029 - 5038
  • Route2
    • null|null
      104151-42-0
    • ~0%
    • In-stock
      3-Methylbenzo[d]thiazol-3-ium iodide|CS-0112720
      2786-31-4
    • In-stock
      Acetophenone|CS-0015982
      98-86-2

    References

    • Chikashita, Hidenori; Ishihara, Masayuki; Itoh, Kazayoshi Heterocycles, 1985 , vol. 23, # 10 p. 2467 - 2472
  • Route3
    • null|null
      2786-70-1
    • ~%
    • In-stock
      3-Methylbenzo[d]thiazol-3-ium iodide|CS-0112720
      2786-31-4

    References

    • Metzger,J. et al. Bulletin de la Societe Chimique de France, 1964 , p. 2857 - 2867

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   3.88
  • LogP   -1.2702
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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