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CS-W001157 4
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2-Amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

  • CAS No. 42159-76-2

  • Cat. No. CS-0307973
  • Purity≥98%
  • MDL No.None

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

2-Amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile|CS-0307973

Structure of 42159-76-2

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General Information

  • CAS No. 42159-76-2
  • Cat. No. CS-0307973
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈N₂S
  • Molecular Weight 234.36
  • Synonym(s) None
  • SMILES CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)N

Synthesis

  • Route1
    • 2-[4-(1,1-Dimethylethyl)cyclohexylidene]propanedinitrile|CS-0617853
      35704-28-0
    • ~97%
    • In-stock
      2-Amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile|CS-0307973
      42159-76-2

    References

    • Feroci, Marta; Chiarotto, Isabella; Rossi, Leucio; Inesi, Achille Advanced Synthesis and Catalysis, 2008 , vol. 350, # 17 p. 2740 - 2746

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-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   49.81
  • LogP   3.35298
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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