2-[4-(4-Chlorobenzyl)Phenoxy]-2-Methylbutanoic Acid

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Properties Simple | Detailed

Formula C18H19ClO3
IUPAC Name (2r)-2-[4-[(4-chlorophenyl)methyl]phenoxy]-2-methyl-butanoic acid
Molecular Mass 318.795 g·mol−1
Heat of Formation -469.2 ± 16.7 kJ·mol−1
Dipole Moment 1.16 ± 1.08 D
Volume 385.03 Å 3
Surface Area 332.92 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
InChIKey PBRVZNUUAUSXBJ-GOSISDBHSA-N
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Elements H C O Cl