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CS-W001157 4
Total: USD 88.00

2-Phenylethanethioamide

  • CAS No. 645-54-5

  • Cat. No. CS-0206469
  • Purity≥98%
  • MDL No.MFCD00022177

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

2-Phenylethanethioamide|CS-0206469

Structure of 645-54-5

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General Information

  • CAS No. 645-54-5
  • Cat. No. CS-0206469
  • Purity ≥98%
  • MDL No. MFCD00022177
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NS
  • Molecular Weight 151.23
  • Synonym(s) Benzeneethanethioamide
  • SMILES C1=CC=C(C=C1)CC(=S)N

Synthesis

  • Route1
    • null|null
      140-29-4
    • ~88%
    • In-stock
      2-Phenylethanethioamide|CS-0206469
      645-54-5

    References

    • Benner, Steven A. Tetrahedron Letters, 1981 , vol. 22, # 20 p. 1851 - 1854
  • Route2

    References

    • Raucher, Stanley; Klein, Peter Tetrahedron Letters, 1980 , vol. 21, p. 4061 - 4064
  • Route3
    • null|null
      60899-79-8
    • null|null
      140-29-4
    • ~55%
    • In-stock
      2-Phenylethanethioamide|CS-0206469
      645-54-5

    References

    • Takeda Chemical Industries, Ltd. Patent: US6248766 B1, 2001 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.5152
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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