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CS-W001157 4
Total: USD 88.00

Azepane-1-carbothioamide

  • CAS No. 68881-66-3

  • Cat. No. CS-0265260
  • Molecule weight158.26
  • Purity98+%
  • MDL No.None

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

Azepane-1-carbothioamide|CS-0265260

Structure of 68881-66-3

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General Information

  • CAS No. 68881-66-3
  • Cat. No. CS-0265260
  • Purity 98+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₄N₂S
  • Molecular Weight 158.26
  • Synonym(s) UKRORGSYN-BB BBV-027300
  • SMILES NC(N1CCCCCC1)=S

Synthesis

  • Route1
    • Azepane-1-carbonitrile|CS-0966289
      5321-89-1
    • ~77%
    • Azepane-1-carbothioamide|CS-0265260
      68881-66-3

    References

    • Funnell, Richard A.; Meakins, G. Denis; Peach, Josephine M.; Price, Susan J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1987 , p. 2311 - 2316
  • Route2
    • null|null
      111-49-9
    • ~%
    • Azepane-1-carbothioamide|CS-0265260
      68881-66-3

    References

    • Funnell, Richard A.; Meakins, G. Denis; Peach, Josephine M.; Price, Susan J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1987 , p. 2311 - 2316

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

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Computational Chemistry Data

  • TPSA   29.26
  • LogP   1.106
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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