2-(4-Tert-Butylphenoxy)-7-(4-Chlorophenyl)Heptanoic Acid

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Properties Simple | Detailed

Formula C23H29ClO3
IUPAC Name (2s)-2-(4-tert-butylphenoxy)-7-(4-chlorophenyl)heptanoic acid
Molecular Mass 388.928 g·mol−1
Heat of Formation -577.1 ± 16.7 kJ·mol−1
Dipole Moment 2.47 ± 1.08 D
Volume 507.63 Å 3
Surface Area 413.24 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
InChIKey GTVAMRIODYMSGH-NRFANRHFSA-N
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Elements H C O Cl