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CS-W001157 4
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2-((2-Chlorobenzyl)thio)-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile

  • CAS No. 626227-53-0

  • Cat. No. CS-0331570
  • Purity≥97%
  • MDL No.None

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

2-((2-Chlorobenzyl)thio)-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile|CS-0331570

Structure of 626227-53-0

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General Information

  • CAS No. 626227-53-0
  • Cat. No. CS-0331570
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₁₆ClF₃N₂S
  • Molecular Weight 396.86
  • Synonym(s) 2-[(2-chlorobenzyl)sulfanyl]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
  • SMILES C1CCC2=C(C(=C(N=C2CC1)SCC3=C(C=CC=C3)Cl)C#N)C(F)(F)F

Safety Information

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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

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Computational Chemistry Data

  • TPSA   36.68
  • LogP   6.18668
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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