Cas no 1026796-77-9 (tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate)

Tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate is a versatile bifunctional azetidine derivative, commonly employed as a key intermediate in pharmaceutical synthesis. Its Boc-protected amine and secondary amine functionalities enable selective modifications, while the azetidine rings enhance conformational rigidity, improving binding affinity in drug design. The compound offers high purity and stability, facilitating efficient downstream applications.
tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate structure
1026796-77-9 structure
Product Name:tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate
CAS No:1026796-77-9
MF:C11H21N3O2
MW:227.303342580795
MDL:MFCD13195000
CID:1034596
PubChem ID:53484485
Update Time:2025-06-20

tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 3-amino-[1,3'-biazetidine]-1'-carboxylate
    • tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate
    • [1,3'-Biazetidine]-1'-carboxylic acid,3-aMino-, 1,1-diMethylethyl ester
    • CS-0444785
    • tert-Butyl 3-amino-1,3'-biazetidine-1'-carboxylate
    • EN300-7435280
    • tert-Butyl 3-amino[1,3'-biazetidine]-1'-carboxylate
    • 3-AMino-[1,3']biazetidinyl-1'-carboxylic acid tert-butyl ester
    • DTXSID10704042
    • A896734
    • (1,3'-Biazetidine)-1'-carboxylic acid,3-amino-,1,1-dimethylethyl ester
    • J-500090
    • AKOS016014546
    • SB51974
    • tert-Butyl3-amino-[1,3'-biazetidine]-1'-carboxylate
    • 1026796-77-9
    • SCHEMBL255895
    • MDL: MFCD13195000
    • Inchi: 1S/C11H21N3O2/c1-11(2,3)16-10(15)14-6-9(7-14)13-4-8(12)5-13/h8-9H,4-7,12H2,1-3H3
    • InChI Key: JMLRKNIOMIWIKZ-UHFFFAOYSA-N
    • SMILES: O(C(C)(C)C)C(N1CC(C1)N1CC(C1)N)=O

Computed Properties

  • Exact Mass: 227.16337692g/mol
  • Monoisotopic Mass: 227.16337692g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 275
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.1
  • Topological Polar Surface Area: 58.8?2

tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate Security Information

tert-butyl 3-(3-aminoazetidin-1-yl)azetidine-1-carboxylate Pricemore >>

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