[4-(3-{4-[(2R)-2-Hydroxy-3,3-Dimethylbutoxy]-3-Methylphenyl}-3-Pentanyl)-2-Methylphenoxy]Acetic Acid

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Properties Simple | Detailed

Formula C27H38O5
IUPAC Name 2-[4-[1-ethyl-1-[4-[(2r)-2-hydroxy-3,3-dimethyl-butoxy]-3-methyl-phenyl]propyl]-2-methyl-phenoxy]acetic acid
Molecular Mass 442.588 g·mol−1
Heat of Formation -964.6 ± 16.7 kJ·mol−1
Dipole Moment 2.72 ± 1.08 D
Volume 571.92 Å 3
Surface Area 463.83 Å 2
HOMO Energy -8.50 ± 0.55 eV
LUMO Energy 3.29 ± eV
Point Group Symmetry C1
InChIKey PMGXXWMCGADHQY-DEOSSOPVSA-N
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Elements H C O