3-{[(1E)-1-Carboxy-3-Methyl-1-Buten-1-Yl]Oxy}-2-Hydroxybenzoic Acid

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Properties Simple | Detailed

Formula C13H14O6
IUPAC Name 3-[(z)-1-carboxy-3-methyl-but-1-enoxy]-2-hydroxy-benzoic acid
Molecular Mass 266.247 g·mol−1
Heat of Formation -981.9 ± 16.7 kJ·mol−1
Dipole Moment 3.83 ± 1.08 D
Volume 306.46 Å 3
Surface Area 279.69 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
InChIKey JVNCGLFIPFSTSG-POHAHGRESA-N
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