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CS-W001157 4
Total: USD 88.00

6-Methyl-3H-1,3-benzothiazol-2-one

  • CAS No. 53827-53-5

  • Cat. No. CS-0061341
  • Molecule weight165.21
  • Purity≥97%
  • MDL No.None

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

6-Methyl-3H-1,3-benzothiazol-2-one|CS-0061341

Structure of 53827-53-5

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General Information

  • CAS No. 53827-53-5
  • Cat. No. CS-0061341
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NOS
  • Molecular Weight 165.21
  • Synonym(s) 6-Methylbenzo[d]thiazol-2(3H)-one
  • SMILES CC1=CC2=C(C=C1)N=C(O)S2

Synthesis

  • Route1
    • null|null
      959066-24-1
    • ~72%
    • In-stock
      6-Methyl-3H-1,3-benzothiazol-2-one|CS-0061341
      53827-53-5

    References

    • Li, Jiaojiao; Zhang, Yihua; Jiang, Yongwen; Ma, Dawei Tetrahedron Letters, 2012 , vol. 53, # 20 p. 2511 - 2513
  • Route2
    • null|null
      201230-82-2
    • 2-Amino-5-methylbenzenethiol|CS-0660124
      23451-96-9
    • ~72%
    • In-stock
      6-Methyl-3H-1,3-benzothiazol-2-one|CS-0061341
      53827-53-5

    References

    • Troisi, Luigino; Granito, Catia; Perrone, Serena; Rosato, Francesca Tetrahedron Letters, 2011 , vol. 52, # 33 p. 4330 - 4332
  • Route3
    • null|null
      70292-68-1
    • ~56%
    • In-stock
      6-Methyl-3H-1,3-benzothiazol-2-one|CS-0061341
      53827-53-5

    References

    • Murru, Siva; Mondal, Pravat; Yella, Ramesh; Patel, Bhisma K. European Journal of Organic Chemistry, 2009 , # 31 p. 5406 - 5413

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   33.12
  • LogP   2.31032
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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