(2S)-[4-(8-Fluoro-5-Methyl-3,4-Dihydro-2H-Chromen-6-Yl)-2-Methyl-3-Quinolinyl][(2-Methyl-2-Propanyl)Oxy]Acetic Acid

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Properties Simple | Detailed

Formula C26H28FNO4
IUPAC Name (2s)-2-tert-butoxy-2-[4-(8-fluoro-5-methyl-chroman-6-yl)-2-methyl-3-quinolyl]acetic acid
Molecular Mass 437.503 g·mol−1
Heat of Formation -819.2 ± 16.7 kJ·mol−1
Dipole Moment 6.42 ± 1.08 D
Volume 521.4 Å 3
Surface Area 399.6 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.25 ± eV
Point Group Symmetry C1
InChIKey FPVPQIOUSAJQDM-DEOSSOPVSA-N
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