(1R,4R,5S,8S)-8-(Hydroxymethyl)-4-Isopropyl-1,7-Dimethylbicyclo[3.2.1]Oct-6-Ene-6-Carbaldehyde

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Properties Simple | Detailed

Formula C15H24O2
IUPAC Name (1r,4r,5s,8s)-8-(hydroxymethyl)-4-isopropyl-1,7-dimethyl-bicyclo[3.2.1]oct-6-ene-6-carbaldehyde
Molecular Mass 236.350 g·mol−1
Heat of Formation -429.7 ± 16.7 kJ·mol−1
Dipole Moment 5.04 ± 1.08 D
Volume 319.63 Å 3
Surface Area 259.51 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 2.82 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,4r,5s,8s)-4-isopropyl-1,7-dimethyl-8-methylol-bicyclo[3.2.1]oct-6-ene-6-carbaldehyde
  • (1r,4r,5s,8s)-8-(hydroxymethyl)-1,7-dimethyl-4-propan-2-yl-bicyclo[3.2.1]oct-6-ene-6-carbaldehyde
  • (1r,4r,5s,8s)-8-(hydroxymethyl)-1,7-dimethyl-4-propan-2-ylbicyclo[3.2.1]oct-6-ene-6-carbaldehyde
  • (1r,4r,5s,8s)-8-(hydroxymethyl)-4-isopropyl-1,7-dimethyl-6-bicyclo[3.2.1]oct-6-enecarboxaldehyde
  • (1r,4r,5s,8s)-8-(hydroxymethyl)-4-isopropyl-1,7-dimethyl-bicyclo[3.2.1]oct-6-ene-6-carbaldehyde
  • bicyclo(3.2.1)oct-6-ene-6-carboxaldehyde, 8-(hydroxymethyl)-4-isopropyl-1,7-dimethyl-
InChIKey JNDNSKMAFGPBFU-BEAPCOKYSA-N
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