(4As,10Br)-3-Cyclohexyl-1,2,3,4,4A,5,6,10B-Octahydrobenzo[F]Isoquinoline

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Properties Simple | Detailed

Formula C19H27N
IUPAC Name (3r,4as,10br)-3-cyclohexyl-2,4,4a,5,6,10b-hexahydro-1h-benzo[f]isoquinoline
Molecular Mass 269.424 g·mol−1
Heat of Formation -19.7 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 356.73 Å 3
Surface Area 309.32 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 0.45 ± eV
Point Group Symmetry C1
Synonyms
  • (4as,10br)-3-cyclohexyl-2,4,4a,5,6,10b-hexahydro-1h-benzo[f]isoquinoline
  • 3-cyclohexyl-1,2,3,4,4a,5,6,10b-octahydrobenz(f)isoquinoline
  • benz(f)isoquinoline, 3-cyclohexyl-1,2,3,4,4a,5,6,10b-octahydro-, trans-(+-)-
  • hexoh-benzisoquinoline
CAS Number(s)
  • 140605-06-7
InChIKey FUMLYVJDBXPSSP-VQIMIIECSA-N
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Elements H C N