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CS-W001157 4
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Tert-Butyl octahydro-1H-pyrrolo[2,3-c]pyridine-1-carboxylate

  • CAS No. 169750-88-3

  • Cat. No. CS-WAA0048
  • Purity≥95%
  • MDL No.MFCD13189556

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

Tert-Butyl octahydro-1H-pyrrolo[2,3-c]pyridine-1-carboxylate|CS-WAA0048

Structure of 169750-88-3

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General Information

  • CAS No. 169750-88-3
  • Cat. No. CS-WAA0048
  • Purity ≥95%
  • MDL No. MFCD13189556
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂N₂O₂
  • Molecular Weight 226.32
  • Synonym(s) 1H-Pyrrolo[2,3-c]pyridine-1-carboxylic acid, octahydro-, 1,1-dimethylethyl ester
  • SMILES O=C(N1CCC2C1CNCC2)OC(C)(C)C

Synthesis

  • Route1

    References

    • SUNSHINE LAKE PHARMA CO., LTD.; ZHANG, Jiancun; ZHANG, Yingjun; ZHANG, Weihong; LIU, Bing; ZHANG, Jiquan; LIU, Jinlei; ZHANG, Lu Patent: WO2013/71697 A1, 2013 ; Location in patent: Paragraph 00269 ;
  • Route2

    References

    • BIOGEN IDEC MA INC.; SUNESIS PHARMACEUTICALS, INC.; HOPKINS, Brian, T.; SCOTT, Daniel; CONLON, Patrick; JENKINS, Tracy, J.; POWELL, Noel; GUAN, Bing; CURERVO, Julio, H.; WANG, Deping; TAVERAS, Art Patent: WO2012/58645 A1, 2012 ; WO 2012/058645 A1
  • Route3

    References

    • BIOGEN IDEC MA INC.; SUNESIS PHARMACEUTICALS, INC.; HOPKINS, Brian, T.; SCOTT, Daniel; CONLON, Patrick; JENKINS, Tracy, J.; POWELL, Noel; GUAN, Bing; CURERVO, Julio, H.; WANG, Deping; TAVERAS, Art Patent: WO2012/58645 A1, 2012 ; WO 2012/058645 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

Quality Control

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   1.6053
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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