(2As,4Ar,7S,7Ar,7Br)-7A-(Hydroxymethyl)-2,2,4A-Trimethyl-1,2,3,4,4A,7,7A,7B-Octahydro-2Ah-Cyclobuta[E]Indene-2A,7-Diol

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Properties Simple | Detailed

Formula C15H24O3
IUPAC Name (2as,4ar,7s,7ar,7br)-7a-(hydroxymethyl)-2,2,4a-trimethyl-3,4,7,7b-tetrahydro-1h-cyclobuta[g]indene-2a,7-diol
Molecular Mass 252.349 g·mol−1
Heat of Formation -523.9 ± 16.7 kJ·mol−1
Dipole Moment 2.32 ± 1.08 D
Volume 320.48 Å 3
Surface Area 256.06 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 0.92 ± eV
Point Group Symmetry C1
Synonyms
  • 2ah-cyclobut(e)indene-2a,7-diol, 1,2,3,4,4a,7,7a,7b-octahydro-7a-(hydroxymethyl)-2,2,4a-trimethyl-, (2as-(2aalpha,4aalpha,7beta,7aalpha,7bbeta))-
  • m 189122
  • m189122
  • punctaporonin f
CAS Number(s)
  • 106758-24-1
InChIKey FELGSSRBVNYFNO-GCPZOVCVSA-N
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