Cas no 2786781-65-3 (rel-(7aR,10R,13aR,13bS,13cR)-Dodecahydro-1H,5H,8H-dipyrido[2,1-f:3′,2′,1′-ij][1,6]naphthyridine-10-carbonitrile)

rel-(7aR,10R,13aR,13bS,13cR)-Dodecahydro-1H,5H,8H-dipyrido[2,1-f:3′,2′,1′-ij][1,6]naphthyridine-10-carbonitrile structure
2786781-65-3 structure
Product Name:rel-(7aR,10R,13aR,13bS,13cR)-Dodecahydro-1H,5H,8H-dipyrido[2,1-f:3′,2′,1′-ij][1,6]naphthyridine-10-carbonitrile
CAS No:2786781-65-3
MF:C16H25N3
MW:259.389803647995
CID:6627466
Update Time:2024-02-02

rel-(7aR,10R,13aR,13bS,13cR)-Dodecahydro-1H,5H,8H-dipyrido[2,1-f:3′,2′,1′-ij][1,6]naphthyridine-10-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • rel-(7aR,10R,13aR,13bS,13cR)-Dodecahydro-1H,5H,8H-dipyrido[2,1-f:3′,2′,1′-ij][1,6]naphthyridine-10-carbonitrile
    • Inchi: 1S/C16H25N3/c17-10-13-5-1-7-15-14-6-3-9-18-8-2-4-12(16(14)18)11-19(13)15/h12-16H,1-9,11H2/t12-,13-,14+,15-,16-/m1/s1
    • InChI Key: JKBSUIWAOCQIML-IBEHDNSVSA-N
    • SMILES: N12CCC[C@@]3([H])[C@]1([H])[C@]([H])([C@@]1([H])CCC[C@H](C#N)N1C3)CCC2

Experimental Properties

  • Density: 1.14±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
  • Boiling Point: 405.6±40.0 °C(Predicted)
  • pka: 9.11±0.40(Predicted)
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