Cas no 897086-92-9 (3-propoxyazetidine)

3-Propoxyazetidine is a heterocyclic organic compound featuring an azetidine ring substituted with a propoxy group at the 3-position. This structure imparts unique reactivity and functional versatility, making it valuable in synthetic chemistry and pharmaceutical applications. The strained four-membered azetidine ring enhances its utility as a building block for bioactive molecules, while the propoxy side chain offers tunable lipophilicity and solubility. Its compact, rigid framework is advantageous in drug design, enabling precise spatial control in molecular interactions. The compound’s stability and compatibility with further functionalization make it a useful intermediate in the development of agrochemicals, ligands, and specialty materials.
3-propoxyazetidine structure
3-propoxyazetidine structure
Product Name:3-propoxyazetidine
CAS No:897086-92-9
MF:C6H13NO
MW:115.173521757126
MDL:MFCD09701258
CID:823383
PubChem ID:53404043
Update Time:2025-06-12

3-propoxyazetidine Chemical and Physical Properties

Names and Identifiers

    • 3-Propoxyazetidine hydrochloride
    • 3-Azetidinyl propyl ether
    • 3-propoxyazetidine
    • 3-Propoxy-azetidine
    • 3-Propoxyazetidine (ACI)
    • 897086-92-9
    • SCHEMBL92492
    • SB39696
    • DB-078471
    • AKOS012078770
    • CS-0005431
    • EN300-1146262
    • MDL: MFCD09701258
    • Inchi: 1S/C6H13NO/c1-2-3-8-6-4-7-5-6/h6-7H,2-5H2,1H3
    • InChI Key: QTINDJCUYRJBAY-UHFFFAOYSA-N
    • SMILES: O(C1CNC1)CCC

Computed Properties

  • Exact Mass: 115.1
  • Monoisotopic Mass: 115.1
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 3
  • Complexity: 61.5
  • 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
  • Topological Polar Surface Area: 21.3A^2
  • XLogP3: 0.4

Experimental Properties

  • Density: 0.93
  • Boiling Point: 144.8°C at 760 mmHg
  • Flash Point: 47.5°C
  • Refractive Index: 1.448

3-propoxyazetidine Security Information

  • HazardClass:IRRITANT
  • Storage Condition:Sealed in dry,Room Temperature

3-propoxyazetidine Pricemore >>

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