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CS-W001157 4
Total: USD 88.00

2-(4-Methylphenyl)-1,3-benzothiazole

  • CAS No. 16112-21-3

  • Cat. No. CS-0012589
  • Molecule weight225.31
  • Purity≥98%
  • MDL No.MFCD00030228

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

2-(4-Methylphenyl)-1,3-benzothiazole|CS-0012589

Structure of 16112-21-3

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General Information

  • CAS No. 16112-21-3
  • Cat. No. CS-0012589
  • Purity ≥98%
  • MDL No. MFCD00030228
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₁NS
  • Molecular Weight 225.31
  • Synonym(s) Benzothiazole, 2-(4-methylphenyl)- (9CI)
  • SMILES CC(C=C1)=CC=C1C2=NC3=CC=CC=C3S2

Synthesis

  • Route1
    • null|null
      450376-25-7
    • ~84%
    • In-stock
      2-(4-Methylphenyl)-1,3-benzothiazole|CS-0012589
      16112-21-3

    References

    • Heng, Chang Ma; Xuan, Zhen Jiang Synlett, 2008 , # 9 p. 1335 - 1340
  • Route2
    • Benzothiazole, ≥96%|CS-1269066
      95-16-9
    • N-Methoxy-4-Methylbenzamide|CS-0766159
      25563-06-8
    • ~56%
    • In-stock
      2-(4-Methylphenyl)-1,3-benzothiazole|CS-0012589
      16112-21-3

    References

    • Li, Chengliang; Li, Pinhua; Yang, Jin; Wang, Lei Chemical Communications, 2012 , vol. 48, # 35 p. 4214 - 4216
  • Route3
    • In-stock
      2-Iodoaniline|CS-W007318
      615-43-0
    • null|null
      90016-92-5
    • ~82%
    • In-stock
      2-(4-Methylphenyl)-1,3-benzothiazole|CS-0012589
      16112-21-3

    References

    • Osuka, Atsuhiro; Uno, Yukari; Horiuchi, Hiroharu; Suzuki, Hitomi Synthesis, 1984 , # 2 p. 145 - 146

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   12.89
  • LogP   4.27172
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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