Cas no 3306-69-2 (2-Azabicyclo[2.2.2]octan-3-one)

2-Azabicyclo[2.2.2]octan-3-one structure
3306-69-2 structure
Product Name:2-Azabicyclo[2.2.2]octan-3-one
CAS No:3306-69-2
MF:C7H11NO
MW:125.168341875076
MDL:MFCD16547516
CID:311029
PubChem ID:137887
Update Time:2025-04-19

2-Azabicyclo[2.2.2]octan-3-one Chemical and Physical Properties

Names and Identifiers

    • 2-Azabicyclo[2.2.2]octan-3-one
    • Cyclohexanecarboxylic acid, 4-amino-, lactam
    • 3-Isoquinuclidone
    • 4-Aminocyclohexanecarboxylic acid lactam
    • Isonortropinone
    • NSC 85851
    • CS-0052042
    • EN300-399459
    • AKOS006357059
    • SCHEMBL10474079
    • AMY202100070
    • 3306-69-2
    • MFCD16547516
    • NCIOpen2_001018
    • SCHEMBL85907
    • (1r,4r)-2-azabicyclo[2.2.2]octan-3-one
    • NSC-85851
    • NSC85851
    • 3-azabicyclo[2.2.2]octan-2-one
    • PB30124
    • (1S,4S)-2-AZABICYCLO[2.2.2]OCTAN-3-ONE
    • CZVSOFLNEUYJRJ-UHFFFAOYSA-N
    • Cyclohexanecarboxylic acid, lactam
    • 2-Aza-bicyclo[2.2.2]octan-3-one
    • SY042137
    • A821601
    • EN300-59958
    • CS-15839
    • InChI=1/C7H11NO/c9-7-5-1-3-6(8-7)4-2-5/h5-6H,1-4H2,(H,8,9
    • Z926909656
    • EN300-2985024
    • AS-34454
    • DTXSID60186718
    • FT-0654027
    • 2-Azabicyclo[2,2,2]octan-3-one
    • AKOS005166893
    • STL453938
    • 2-Azabicyclo[2,2,2]-octanone-3
    • 3-Isoquinuclidinone; 3-Isoquinuclidone; 4-Aminocyclohexanecarboxylic acid lactam; Isonortropinone; NSC 85851
    • MDL： MFCD16547516
    • Inchi： 1S/C7H11NO/c9-7-5-1-3-6(8-7)4-2-5/h5-6H,1-4H2,(H,8,9)
    • InChI Key： CZVSOFLNEUYJRJ-UHFFFAOYSA-N
    • SMILES： O=C1C2CCC(CC2)N1

Computed Properties

  • Exact Mass: 125.08413
  • Monoisotopic Mass: 125.084063974g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 136
  • 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: 0.6
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • Density: 1.083±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 200-202 oC (benzene hexane )
  • Solubility: Slightly soluble (5.6 g/l) (25 o C),
  • PSA: 29.1

2-Azabicyclo[2.2.2]octan-3-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
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Fluorochem
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Fluorochem
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Fluorochem
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