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CS-W001157 4
Total: USD 88.00

(S)-1-benzylpyrrolidine-3-carbonitrile

  • CAS No. 159063-16-8

  • Cat. No. CS-0337016
  • Molecule weight186.25
  • Purity≥95%
  • MDL No.None

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

(S)-1-benzylpyrrolidine-3-carbonitrile|CS-0337016

Structure of 159063-16-8

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General Information

  • CAS No. 159063-16-8
  • Cat. No. CS-0337016
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄N₂
  • Molecular Weight 186.25
  • Synonym(s) None
  • SMILES C1=CC=C(C=C1)CN2CC[C@H](C#N)C2

Synthesis

  • Route1
    • null|null
      10442-39-4
    • null|null
      114715-35-4
    • ~87%
    • (S)-1-benzylpyrrolidine-3-carbonitrile|CS-0337016
      159063-16-8

    References

    • Warner-Lambert Company Patent: US5347017 A1, 1994 ;
  • Route2
    • null|null
      143-33-9
    • null|null
      114715-35-4
    • ~90%
    • (S)-1-benzylpyrrolidine-3-carbonitrile|CS-0337016
      159063-16-8

    References

    • Thomas, Christoph; Orecher, Florian; Gmeiner, Peter Synthesis, 1998 , # 10 p. 1491 - 1496
  • Route3
    • null|null
      2408-36-8
    • null|null
      114715-35-4
    • ~59%
    • (S)-1-benzylpyrrolidine-3-carbonitrile|CS-0337016
      159063-16-8

    References

    • Gmeiner, Peter; Orecher, Florian; Thomas, Christoph; Weber, Klaus Tetrahedron Letters, 1995 , vol. 36, # 3 p. 381 - 382

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   27.03
  • LogP   2.03208
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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