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CS-W001157 4
Total: USD 88.00

2-Methyl-3,4-dihydro-2h-1-benzothiopyran-4-one

  • CAS No. 826-86-8

  • Cat. No. CS-0260523
  • Purity≥97%
  • MDL No.None

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

2-Methyl-3,4-dihydro-2h-1-benzothiopyran-4-one|CS-0260523

Structure of 826-86-8

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General Information

  • CAS No. 826-86-8
  • Cat. No. CS-0260523
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀OS
  • Molecular Weight 178.25
  • Synonym(s) 4H-1-Benzothiopyran-4-one, 2,3-dihydro-2-methyl-
  • SMILES O=C1CC(C)SC2=CC=CC=C12

Synthesis

  • Route1
    • null|null
      771-40-4
    • ~66%
    • 2-Methyl-3,4-dihydro-2h-1-benzothiopyran-4-one|CS-0260523
      826-86-8

    References

    • Kumar; Rao; Pandey Synthetic Communications, 1994 , vol. 24, # 22 p. 3297 - 3306
  • Route2
    • null|null
      880-13-7
    • ~94%
    • 2-Methyl-3,4-dihydro-2h-1-benzothiopyran-4-one|CS-0260523
      826-86-8

    References

    • Clayton, Stephen E.; Gabbutt, Christopher D.; Hepworth, John D.; Mark Heron Tetrahedron, 1993 , vol. 49, # 4 p. 939 - 946
  • Route3
    • null|null
      110-89-4
    • In-stock
      (E)-Crotonic acid|CS-0017976
      107-93-7
    • null|null
      7664-93-9
    • null|null
      108-98-5
    • ~%
    • 2-Methyl-3,4-dihydro-2h-1-benzothiopyran-4-one|CS-0260523
      826-86-8

    References

    • The Boots Company PLC Patent: EP354694 A1, 1990 ;

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.7536
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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