2-Methyl-5-[(2R)-6-Methyl-5-Hepten-2-Yl]Phenol

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Properties Simple | Detailed

Formula C15H22O
IUPAC Name 5-[(1r)-1,5-dimethylhex-4-enyl]-2-methyl-phenol
Molecular Mass 218.335 g·mol−1
Heat of Formation -244.1 ± 16.7 kJ·mol−1
Dipole Moment 0.96 ± 1.08 D
Volume 311.08 Å 3
Surface Area 269.62 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 3.24 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-5-(1,5-dimethyl-4-hexenyl)-2-methylphenol
  • (r)-5-(1,5-dimethyl-4-hexenyl)-o-cresol
  • (r)-5-(1-5-dimethyl-4-hexenyl)-2-methylphenol
  • 2-methyl-5-[(2r)-6-methylhept-5-en-2-yl]phenol
  • 5-[(1r)-1,5-dimethylhex-4-enyl]-2-methyl-phenol
  • 5-[(1r)-1,5-dimethylhex-4-enyl]-2-methylphenol
  • phenol, 5-(1,5-dimethyl-4-hexenyl)-2-methyl-, (-)-
  • phenol, 5-[(1r)-1,5-dimethyl-4-hexenyl]-2-methyl-
  • smp1_000318
  • xanthorrhizol
CAS Number(s)
  • 30199-26-9
InChIKey FKWGCEDRLNNZOZ-GFCCVEGCSA-N
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