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tert-Butyl 3-[methoxy(methyl)carbamoyl]azetidine-1-carboxylate

  • CAS No. 820971-67-3

  • Cat. No. CS-0048337
  • Molecule weight244.29
  • Purity≥97%
  • MDL No.None

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

tert-Butyl 3-[methoxy(methyl)carbamoyl]azetidine-1-carboxylate|CS-0048337

Structure of 820971-67-3

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General Information

  • CAS No. 820971-67-3
  • Cat. No. CS-0048337
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₀N₂O₄
  • Molecular Weight 244.29
  • Synonym(s) 1-Azetidinecarboxylic acid, 3-[(methoxymethylamino)carbonyl]-,1,1-dimethylethyl ester
  • SMILES CON(C)C(=O)C1CN(C1)C(=O)OC(C)(C)C

Synthesis

  • Route1

    References

    • PFIZER LIMITED; ACIRO, Caroline; BAGAL, Sharanjeet Kaur; HARVEY, John Wilson; JONES, Lyn Howard; MOWBRAY, Charles Eric; OWEN, Robert McKenzie; SABNIS, Yogesh Anil; STORER, Robert Ian; YEAP, Siew Kuen Patent: WO2010/131145 A1, 2010 ; Location in patent: Page/Page column 86 ;
  • Route2

    References

    • GAWECO, Anderson; WALKER, John; MONAHAN, Joseph, B.; CUBBAGE, Jerry, W.; CARROLL, Jeffery Patent: WO2012/9649 A1, 2012 ; Location in patent: Page/Page column 92-93 ;

Safety Information

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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   59.08
  • LogP   0.8731
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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