Cas no 16625-11-9 (2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol,7-ethyl-1,4,5,6,7,8,9,10-octahydro-, (5S,7R)- (9CI))

2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol,7-ethyl-1,4,5,6,7,8,9,10-octahydro-, (5S,7R)- (9CI) structure
16625-11-9 structure
Product Name:2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol,7-ethyl-1,4,5,6,7,8,9,10-octahydro-, (5S,7R)- (9CI)
CAS No:16625-11-9
MF:C19H26N2O
MW:298.422544956207
CID:147044
Update Time:2024-03-01

2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol,7-ethyl-1,4,5,6,7,8,9,10-octahydro-, (5S,7R)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol,7-ethyl-1,4,5,6,7,8,9,10-octahydro-, (5S,7R)- (9CI)
    • 2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol,7-ethyl-1,4,5,6,7,8,9,10-octahydro-, [5S-(5R*,7S*)]-
    • Conoflorinol B
    • Voaphyllinol B (8CI)
    • 2H-3,7-Methanoazacycloundecino[5,4-b]indol-5-ol, 7-ethyl-1,4,5,6,7,8,9,10-octahydro-, (5S,7R)- (9CI)
    • Inchi: 1S/C19H26N2O/c1-2-19-9-7-18-16(15-5-3-4-6-17(15)20-18)8-10-21(13-19)12-14(22)11-19/h3-6,14,20,22H,2,7-13H2,1H3/t14-,19+/m0/s1
    • InChI Key: SPZYFIPXSJYCEM-IFXJQAMLSA-N
    • SMILES: N1C2=C(C=CC=C2)C2CCN3C[C@@](CC)(C[C@H](O)C3)CCC1=2

Computed Properties

  • Exact Mass: 272.08309

Experimental Properties

  • Density: 1.19±0.1 g/cm3(Predicted)
  • Melting Point: 125-127 °C(Solv: cyclohexane (110-82-7))
  • Boiling Point: 476.6±45.0 °C(Predicted)
  • PSA: 52.54
  • pka: 14.74±0.40(Predicted)
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