2-(4-Sulfophenyl)Butanoate

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Properties Simple | Detailed

Formula C10H12O5S
IUPAC Name (2z)-2-(4-sulfocyclohexa-2,4-dien-1-ylidene)butanoic acid
Molecular Mass 244.264 g·mol−1
Heat of Formation 565.3 ± 16.7 kJ·mol−1
Dipole Moment 2.05 ± 1.08 D
Volume 232.45 Å 3
Surface Area 227.26 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry Cs
InChIKey UBOLIQIJRBLRGQ-SECBINFHSA-N
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Elements C S O