Phenyl 2-Hydroxy-4-(Methylsulfanyl)Butanoate

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Properties Simple | Detailed

Formula C11H14O3S
IUPAC Name phenyl (2s)-2-hydroxy-4-methylsulfanyl-butanoate
Molecular Mass 226.292 g·mol−1
Heat of Formation -453.5 ± 16.7 kJ·mol−1
Dipole Moment 1.45 ± 1.08 D
Volume 272.32 Å 3
Surface Area 258.72 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
InChIKey AWNQIINMEWFURK-JTQLQIEISA-N
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