Cas no 329-96-4 (9-oxa-3,7-diazabicyclo[3.3.1]nonane)

9-oxa-3,7-diazabicyclo[3.3.1]nonane structure
329-96-4 structure
Product Name:9-oxa-3,7-diazabicyclo[3.3.1]nonane
CAS No:329-96-4
MF:C6H12N2O
MW:128.172281265259
CID:917466
PubChem ID:268850
Update Time:2025-04-19

9-oxa-3,7-diazabicyclo[3.3.1]nonane Chemical and Physical Properties

Names and Identifiers

    • 9-oxa-3,7-diazabicyclo[3.3.1]nonane
    • 9-oxa-3,7-diaza-bicyclo[3.3.1]nonane
    • 9-Oxa-bispidin
    • AC1L6L5C
    • AC1Q6ZZZ
    • AG-K-70701
    • AR-1H5924
    • CTK4G9694
    • NSC109303
    • SureCN2333679
    • AKOS006354496
    • NSC-109303
    • 329-96-4
    • EN300-153916
    • SCHEMBL2333679
    • DTXSID10296432
    • Inchi: 1S/C6H12N2O/c1-5-2-8-4-6(9-5)3-7-1/h5-8H,1-4H2
    • InChI Key: QPZGDXHVVSBMCO-UHFFFAOYSA-N
    • SMILES: O1C2CNCC1CNC2

Computed Properties

  • Exact Mass: 128.09506
  • Monoisotopic Mass: 128.094963011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 87.2
  • 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: -1.1
  • Topological Polar Surface Area: 33.3?2

Experimental Properties

  • PSA: 33.29
  • LogP: -0.39580
Recommended suppliers
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Jinhuan Chemical CO., LTD.
Nanjing Jubai Biopharm
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
上海帛亦醫(yī)藥科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shaanxi pure crystal photoelectric technology co. LTD
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited