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CS-W001157 4
Total: USD 88.00

(R)-1-benzylpyrrolidine-3-carbonitrile

  • CAS No. 157528-56-8

  • Cat. No. CS-0464054
  • Molecule weight186.25
  • Purity≥98%
  • MDL No.MFCD09951967

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

(R)-1-benzylpyrrolidine-3-carbonitrile|CS-0464054

Structure of 157528-56-8

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General Information

  • CAS No. 157528-56-8
  • Cat. No. CS-0464054
  • Purity ≥98%
  • MDL No. MFCD09951967
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄N₂
  • Molecular Weight 186.25
  • Synonym(s) (R)-1-Benzyl-3-pyrrolidinecarbonitrile
  • SMILES C1=CC=C(C=C1)CN2CC[C@@H](C#N)C2

Synthesis

  • Route1
    • null|null
      10442-39-4
    • (s)-1-Benzylpyrrolidin-3-yl methanesulfonate|CS-0688655
      118354-71-5
    • ~88%
    • (R)-1-benzylpyrrolidine-3-carbonitrile|CS-0464054
      157528-56-8

    References

    • Fedij, Victor; Lenoir, Edward A.; Suto, Mark J.; Zeller, James R.; Wemple, James Tetrahedron: Asymmetry, 1994 , vol. 5, # 7 p. 1131 - 1134
  • Route2
    • null|null
      143-33-9
    • (s)-1-Benzylpyrrolidin-3-yl methanesulfonate|CS-0688655
      118354-71-5
    • ~71%
    • (R)-1-benzylpyrrolidine-3-carbonitrile|CS-0464054
      157528-56-8

    References

    • WARNER-LAMBERT COMPANY LLC Patent: WO2005/49605 A1, 2005 ; Location in patent: Page/Page column 115; 116; 148 ;
  • Route3
    • null|null
      908598-98-1
    • ~%
    • (R)-1-benzylpyrrolidine-3-carbonitrile|CS-0464054
      157528-56-8

    References

    • Synthesis, , # 10 p. 1491 - 1496

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+H312+H332-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-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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