(2S)-2,3-Dihydro-1,4-Benzodioxine-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C9H8O4
IUPAC Name (3s)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid
Molecular Mass 180.157 g·mol−1
Heat of Formation -554.4 ± 16.7 kJ·mol−1
Dipole Moment 1.56 ± 1.08 D
Volume 195.44 Å 3
Surface Area 193.61 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 2.94 ± eV
Point Group Symmetry C1
Synonyms
  • (s)-1,4-benzodioxane-2-carboxylic acid
  • (s)-2,3-dihydro-1,4-benzodioxin-2-carboxylic acid
InChIKey HMBHAQMOBKLWRX-QMMMGPOBSA-N
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Elements H C O