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CS-W001157 4
Total: USD 88.00

2-Phenylbenzothiazole

  • CAS No. 883-93-2

  • Cat. No. CS-0095852
  • Purity≥98%
  • MDL No.None

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

2-Phenylbenzothiazole|CS-0095852

Structure of 883-93-2

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General Information

  • CAS No. 883-93-2
  • Cat. No. CS-0095852
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉NS
  • Molecular Weight 211.28
  • Synonym(s) Benzothiazole, 2-phenyl-
  • SMILES C1(C2=CC=CC=C2)=NC3=CC=CC=C3S1

Description

2-Phenylbenzothiazole was used in the synthesis of two novel orange iridium(III) complexes, (bis[2-(biphenyl-3-yl)benzothiazole-N,C2]iridium(III)(acetylacetonate) and bis[2-(4-methoxybiphenyl-3-yl)benzothiazole-N,C2]iridium(III) (acetylacetonate).

Application

2-Phenylbenzothiazole serves as a robust heterocyclic scaffold in medicinal chemistry, enabling efficient construction of bioactive molecules through electrophilic substitution and transition-metal-catalyzed coupling reactions. Its stability under standard reaction conditions and tolerance to diverse functional groups make it a practical building block for pharmaceutical intermediates and materials science applications.

Synthesis

  • Route1
    • 2-Phenyl-2,3-dihydrobenzo[d]thiazole|CS-1153281
      31230-83-8
    • ~99%
    • In-stock
      2-Phenylbenzothiazole|CS-0095852
      883-93-2

    References

    • Journal of Molecular Structure, , vol. 1011, p. 81 - 93
  • Route2
    • null|null
      137-07-5
    • In-stock
      Benzoic acid|CS-0008257
      65-85-0
    • ~93%
    • In-stock
      2-Phenylbenzothiazole|CS-0095852
      883-93-2

    References

    • Synlett, , # 2 p. 313 - 317
  • Route3
    • null|null
      137-07-5
    • In-stock
      Benzyl alcohol|CS-4355
      100-51-6
    • ~94%
    • In-stock
      2-Phenylbenzothiazole|CS-0095852
      883-93-2

    References

    • Applied Organometallic Chemistry, , vol. 27, # 10 p. 606 - 610

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H319-H413
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   3.9633
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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