(2R,3S,6R)-2-Bromo-8-Chloro-1,1,9-Trimethyl-5-Methylenespiro[5.5]Undec-8-En-3-Ol

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Properties Simple | Detailed

Formula C15H22BrClO
IUPAC Name (3s,4r,6r)-4-bromo-10-chloro-5,5,9-trimethyl-1-methylene-spiro[5.5]undec-9-en-3-ol
Molecular Mass 333.692 g·mol−1
Heat of Formation -284.7 ± 16.7 kJ·mol−1
Dipole Moment 3.13 ± 1.08 D
Volume 346.79 Å 3
Surface Area 275.13 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,6r)-2-bromo-10-chloro-1,1,9-trimethyl-5-methylene-3-spiro[5.5]undec-9-enol
  • (2r,3s,6r)-2-bromo-10-chloro-1,1,9-trimethyl-5-methylene-spiro[5.5]undec-9-en-3-ol
  • (2r,3s,6r)-2-bromo-10-chloro-1,1,9-trimethyl-5-methylidene-spiro[5.5]undec-9-en-3-ol
  • (2r,3s,6r)-2-bromo-10-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-9-en-3-ol
  • (3s,4r,6r)-4-bromo-8-chloro-5,5,9-trimethyl-1-methylenespiro[5.5]undec-8-en-3-ol
InChIKey HZKGRCIKQBHSNA-KCQAQPDRSA-N
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Elements H C O Br Cl