Ethyl (3S)-3-Phenylbutanoate

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Properties Simple | Detailed

Formula C12H16O2
IUPAC Name ethyl (3s)-3-phenylbutanoate
Molecular Mass 192.254 g·mol−1
Heat of Formation -376.0 ± 16.7 kJ·mol−1
Dipole Moment 1.88 ± 1.08 D
Volume 255.47 Å 3
Surface Area 223.3 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 0.22 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-phenylbutanoic acid ethyl ester
  • (3s)-3-phenylbutyric acid ethyl ester
InChIKey SJPWEMZQXWYDSY-JTQLQIEISA-N
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Elements H C O