Methyl (2S)-2-(4-Chlorophenyl)-3-Methylbutanoate

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Formula C12H15ClO2
IUPAC Name methyl (2s)-2-(4-chlorophenyl)-3-methyl-butanoate
Molecular Mass 226.699 g·mol−1
Heat of Formation -395.9 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 280.66 Å 3
Surface Area 251.62 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
InChIKey YLOVJTBYAMJJPN-NSHDSACASA-N
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Elements H C O Cl