Cas no 77549-88-3 (3aH-Furo[2,3-b]indol-3a-ol,8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro- (9CI))

3aH-Furo[2,3-b]indol-3a-ol,8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro- (9CI) structure
77549-88-3 structure
Product Name:3aH-Furo[2,3-b]indol-3a-ol,8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro- (9CI)
CAS No:77549-88-3
MF:C19H24N2O2
MW:312.406064987183
CID:580340
PubChem ID:157080
Update Time:2025-04-19

3aH-Furo[2,3-b]indol-3a-ol,8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 3aH-Furo[2,3-b]indol-3a-ol,8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro- (9CI)
    • 3aH-Furo(2,3-b)indol-3a-ol, 8a-(5-ethenyl-1-azabicyclo(2.2.2)oct-2-yl)-2,3,8,8a-tetrahydro-
    • 3aH-Furo[2,3-b]indol-3a-ol, 8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro-
    • 8a-(5-Vinyl-1-azabicyclo(2.2.2)oct-2-yl)-2,3,8,8a-tetrahydro-3aH-furo(2,3-b)indol-3a-ol
    • 8a-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro-3aH-Furo[2,3-b]indol-3a-ol
    • 8a-(5-Vinyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro-3ah-furo[2,3-b]indol-3a-ol
    • CHEMBL5026572
    • (3aS,8bR)-3a-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-2,4-dihydro-1H-furo[2,3-b]indol-8b-ol
    • SCHEMBL2496398
    • 8a-(5-Vinyl-1-azabicyclo[2.2.2]oct-2-yl)-2,3,8,8a-tetrahydro-3ah-furo[2,3-b]indol-3a-ol #
    • DTXSID20871638
    • 77549-88-3
    • 464-85-7
    • B2703-477456
    • Quinamine
    • 3a-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-2,4-dihydro-1H-furo[2,3-b]indol-8b-ol
    • AKOS032949027
    • AE-562/12222302
    • 464-86-8
    • NS00043638
    • Conquinamine
    • ALNKTVLUDWIWIH-UHFFFAOYSA-N
    • Oprea1_245257
    • 8a-(5-Ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-2,3,8,8a-tetrahydro-3aH-furo[2,3-b]indol-3a-ol
    • Inchi: 1S/C19H24N2O2/c1-2-13-12-21-9-7-14(13)11-17(21)19-18(22,8-10-23-19)15-5-3-4-6-16(15)20-19/h2-6,13-14,17,20,22H,1,7-12H2
    • InChI Key: ALNKTVLUDWIWIH-UHFFFAOYSA-N
    • SMILES: O1CCC2(C3C=CC=CC=3NC12C1CC2CCN1CC2C=C)O

Computed Properties

  • Exact Mass: 312.184
  • Monoisotopic Mass: 312.184
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 2
  • Complexity: 512
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 5
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 44.7A^2
  • XLogP3: 2.1

Experimental Properties

  • Density: 1.28±0.1 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 487.7°Cat760mmHg
  • Flash Point: 248.7°C
  • Refractive Index: 1.656
  • Solubility: Very slightly soluble (0.62 g/l) (25 o C),
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