3-Cyano-4-oxo-piperidine-1-carboxylic Acid tert-Butyl Ester

CAS: 914988-10-6

Ref. TR-C955865

Product Information

• Name: 3-Cyano-4-oxo-piperidine-1-carboxylic Acid tert-Butyl Ester
• Synonyms: 1-Boc-3-cyano-4-piperidone
• Brand: TRC
• Description: Applications 3-Cyano-4-oxo-piperidine-1-carboxylic Acid tert-Butyl Ester is a useful research reagent for organic synthesis and other chemical processes.References Guo, X., et al.: Molecules, 16, 2626 (2011); Chai, Y., et al.: Bioorg. Med. Chem. Lett., 20, 5195 (2010); Chai, Y., et al.: Bioorg. Med. Chem. Lett., 21, 3377 (2011)

Chemical properties

• Molecular weight: 479.583
• Formula: C₂₈D₃H₂₉N₂O₅
• Color/Form: Neat
• InChI: InChI=1S/C28H32N2O5/c1-29(23(32)7-4-18-9-13-34-16-18)20-8-10-28(33)22-14-19-5-6-21(31)25-24(19)27(28,26(20)35-25)11-12-30(22)15-17-2-3-17/h4-7,9,13,16-17,20,22,26,31,33H,2-3,8,10-12,14-15H2,1H3/b7-4-/t20-,22-,26+,27+,28-/m1/s1/i1D3
• InChI key: InChIKey=XGZZHZMWIXFATA-KYSQGRJDSA-N
• SMILES: [2H]C([2H])([2H])N(C(=O)/C=C\c1ccoc1)[C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5