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CS-W001157 4
Total: USD 88.00

3(S)-Iodomethyl-pyrrolidine-1-carboxylic acid tert-butyl ester

  • CAS No. 224168-68-7

  • Cat. No. CS-0005409
  • Purity≥97%
  • MDL No.MFCD08059340

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

3(S)-Iodomethyl-pyrrolidine-1-carboxylic acid tert-butyl ester|CS-0005409

Structure of 224168-68-7

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General Information

  • CAS No. 224168-68-7
  • Cat. No. CS-0005409
  • Purity ≥97%
  • MDL No. MFCD08059340
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₈INO₂
  • Molecular Weight 311.16
  • Synonym(s) tert-Butyl (3S)-3-(iodomethyl)pyrrolidine-1-carboxylate
  • SMILES O=C(OC(C)(C)C)N(CC1)C[C@H]1CI

Synthesis

  • Route1

    References

    • DAINIPPON SUMITOMO PHARMA CO., LTD.; MIZUNO, Kazuhiro; IKEDA, Junya; NAKAMURA, Takanori; IWATA, Masato; OTAKA, Hiromichi; GOTO, Nana Patent: WO2012/169649 A1, 2012 ; Location in patent: Page/Page column 164; 165 ; WO 2012/169649 A1
  • Route2

    References

    • DAINIPPON SUMITOMO PHARMA CO., LTD.; MIZUNO, Kazuhiro; IKEDA, Junya; NAKAMURA, Takanori; IWATA, Masato; OTAKA, Hiromichi; GOTO, Nana Patent: WO2012/169649 A1, 2012 ; WO 2012/169649 A1

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

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Computational Chemistry Data

  • TPSA   29.54
  • LogP   2.6784
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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