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(S)-tert-Butyl 3-(cyanomethyl)pyrrolidine-1-carboxylate

  • CAS No. 1187931-76-5

  • Cat. No. CS-0005400
  • Purity≥97%
  • MDL No.MFCD06738465

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

(S)-tert-Butyl 3-(cyanomethyl)pyrrolidine-1-carboxylate|CS-0005400

Structure of 1187931-76-5

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General Information

  • CAS No. 1187931-76-5
  • Cat. No. CS-0005400
  • Purity ≥97%
  • MDL No. MFCD06738465
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈N₂O₂
  • Molecular Weight 210.27
  • Synonym(s) tert-butyl (S)-3-cyanomethylpyrrolidine-1-carboxylate
  • SMILES N#CC[C@H]1CN(CC1)C(OC(C)(C)C)=O

Synthesis

  • Route1
    • null|null
      773837-37-9
    • Tert-butyl (R)-3-((tosyloxy)methyl)pyrrolidine-1-carboxylate|CS-0559716
      330797-71-2
    • ~%
    • (S)-tert-Butyl 3-(cyanomethyl)pyrrolidine-1-carboxylate|CS-0005400
      1187931-76-5

    References

    • ZAFGEN, INC.; HUGHES, Thomas, E.; VATH, James, E. Patent: WO2014/71368 A1, 2014 ; Location in patent: Paragraph 00474 ;

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   53.33
  • LogP   2.15708
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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