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CS-W001157 4
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Pyridin-4-ylmethanethiol

  • CAS No. 1822-53-3

  • Cat. No. CS-0570778
  • Molecule weight125.19
  • Purity≥98%
  • MDL No.MFCD06657437

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

Pyridin-4-ylmethanethiol|CS-0570778

Structure of 1822-53-3

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General Information

  • CAS No. 1822-53-3
  • Cat. No. CS-0570778
  • Purity ≥98%
  • MDL No. MFCD06657437
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₇NS
  • Molecular Weight 125.19
  • Synonym(s) Pyridin-4-YL-methanethiol
  • SMILES SCC=1C=CN=CC1

Synthesis

  • Route1

    References

    • Brembilla, Alain; Roizard, Denis; Lochon, Pierre Journal de Chimie Physique et de Physico-Chimie Biologique, 1986 , vol. 83, # 9 p. 577 - 588
  • Route2
    • null|null
      1822-52-2
    • ~6%
    • Pyridin-4-ylmethanethiol|CS-0570778
      1822-53-3

    References

    • Barnes, John H.; Fatome, Marc; Jones, Christopher E. L.; Murray, Stephen G. European Journal of Medicinal Chemistry, 1988 , vol. 23, p. 211 - 216
  • Route3
    • 4-(Chloromethyl)pyridine|CS-0684951
      10445-91-7
    • ~%
    • Pyridin-4-ylmethanethiol|CS-0570778
      1822-53-3

    References

    • Brown, Thomas J.; Chapman, Robert F.; Cook, David C.; Hart, Terance W.; McLay, Iain M.; et al. Journal of Medicinal Chemistry, 1992 , vol. 35, # 20 p. 3613 - 3624

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2810
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P405-P501

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Computational Chemistry Data

  • TPSA   12.89
  • LogP   1.5114
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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