Bay O 6893

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Properties Simple | Detailed

Formula C21H38O4
IUPAC Name (2r,3r,4r)-4-hydroxy-2-(7-hydroxyheptyl)-3-[(e,4s)-4-hydroxy-4-methyl-oct-1-enyl]cyclopentanone
Molecular Mass 354.524 g·mol−1
Heat of Formation -1011.0 ± 16.7 kJ·mol−1
Dipole Moment 4.11 ± 1.08 D
Volume 496.59 Å 3
Surface Area 404.14 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 0.85 ± eV
Point Group Symmetry C1
InChIKey SPOAFZKFCYREMW-UDHCHFQSSA-N
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Elements H C O