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CS-W001157 4
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1-[(Benzyloxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid

  • CAS No. 912444-75-8

  • Cat. No. CS-0055379
  • Purity≥98%
  • MDL No.MFCD18274759

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

1-[(Benzyloxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid|CS-0055379

Structure of 912444-75-8

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General Information

  • CAS No. 912444-75-8
  • Cat. No. CS-0055379
  • Purity ≥98%
  • MDL No. MFCD18274759
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₇NO₄
  • Molecular Weight 263.29
  • Synonym(s) 1-(benzyloxymethyl)-6-chloropyrimidine-2,4(1H,3H)-dione
  • SMILES O=C(C1(C)CN(C(OCC2=CC=CC=C2)=O)CC1)O

Synthesis

  • Route1
    • 1-Benzyl 3-methyl 3-methylpyrrolidine-1,3-dicarboxylate|CS-0055378
      912444-74-7
    • ~98%
    • 1-[(Benzyloxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid|CS-0055379
      912444-75-8

    References

    • ARRAY BIOPHARMA INC. Patent: WO2009/140320 A1, 2009 ; Location in patent: Page/Page column 74 ; WO 2009/140320 A1
  • Route2
    • null|null
      1446482-09-2
    • ~96%
    • 1-[(Benzyloxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid|CS-0055379
      912444-75-8

    References

    • Nagata, Kazuhiro; Kuga, Yasushi; Higashi, Akinori; Kinoshita, Atsushi; Kanemitsu, Takuya; Miyazaki, Michiko; Itoh, Takashi Journal of Organic Chemistry, 2013 , vol. 78, # 14 p. 7131 - 7136
  • Route3
    • null|null
      1446482-06-9
    • ~%
    • 1-[(Benzyloxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid|CS-0055379
      912444-75-8

    References

    • Nagata, Kazuhiro; Kuga, Yasushi; Higashi, Akinori; Kinoshita, Atsushi; Kanemitsu, Takuya; Miyazaki, Michiko; Itoh, Takashi Journal of Organic Chemistry, 2013 , vol. 78, # 14 p. 7131 - 7136

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   66.84
  • LogP   2.1198
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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