Cas no 202797-03-3 (Tert-butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate)

Tert-butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate structure
202797-03-3 structure
Product Name:Tert-butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
CAS No:202797-03-3
MF:C13H24N2O2
MW:240.341863632202
MDL:MFCD20275543
CID:820407
PubChem ID:23283006
Update Time:2025-09-24

Tert-butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • endo-3-Amino-N-Boc-9-azabicyclo[3.3.1]nonane
    • endo-3-Amino-N-Boc-9-azabicyclo[3,3,1]nonane
    • 3-amino-n-boc-9-azabicyclo[3.3.1]nonane
    • ENDO-3-AMINO-9-BOC-9-AZABICYCLO[3.3.1]NONANE
    • endo-tert-Butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • (endo)-tert-Butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • 9-Boc-9-azabicyclo[3.3.1]nonan-3-amine
    • (3-exo)-tert-Butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • tert-Butyl (1S,5R)-3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • W
    • 3-Amino-9-aza-bicyclo[3.3.1]nonane-9-carboxylic acid tert-butyl ester
    • 9-Azabicyclo[3.3.1]nonane-9-carboxylic acid, 3-amino-, 1,1-dimethylethyl ester
    • exo-9-Boc-9-azabicyclo[3.3.1]nonan-3-amine
    • MFCD12198904
    • AKOS015950605
    • SB19940
    • BCP32186
    • SY099792
    • 202797-03-3
    • PB20738
    • WVEPNZWEHKIHOM-UHFFFAOYSA-N
    • SCHEMBL8185274
    • AS-31508
    • endo-9-Boc-9-azabicyclo[3.3.1]nonan-3-amine
    • AC-22441
    • Endo-3-Amino-N-Boc-9-azabicyclo[3.3.1]nonane;3-Amino-N-Boc-9-azabicyclo[3.3.1]nonane
    • MFCD20275543
    • SY098298
    • MFCD12198833
    • t-Butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • DTXSID00632527
    • tert-butyl endo-3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • EN300-6481350
    • CS-0051533
    • PB16503
    • 3-amino-9-t-butoxycarbonyl-9-azabicyclo[3.3.1]nonane
    • SY002484
    • Tert-butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate
    • MDL： MFCD20275543
    • Inchi： 1S/C13H24N2O2/c1-13(2,3)17-12(16)15-10-5-4-6-11(15)8-9(14)7-10/h9-11H,4-8,14H2,1-3H3
    • InChI Key： WVEPNZWEHKIHOM-UHFFFAOYSA-N
    • SMILES： O(C(C)(C)C)C(N1C2CCCC1CC(C2)N)=O

Computed Properties

  • Exact Mass: 240.18400
  • Monoisotopic Mass: 240.184
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 284
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 55.6
  • XLogP3: 1.7

Experimental Properties

  • Density: 1.061
  • Boiling Point: 331.1 ℃ at 760 mmHg
  • Flash Point: 331.1 °C at 760 mmHg
  • Refractive Index: 1.502
  • PSA: 55.56000
  • LogP: 2.90390

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