Methyl 3-(Isobutyryloxy)[1]Benzothieno[3,2-B]Furan-2-Carboxylate

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Properties Simple | Detailed

Formula C16H14O5S
IUPAC Name methyl 3-(2-methylpropanoyloxy)benzothiopheno[3,2-b]furan-2-carboxylate
Molecular Mass 318.344 g·mol−1
Heat of Formation -578.9 ± 16.7 kJ·mol−1
Dipole Moment 3.20 ± 1.08 D
Volume 353.12 Å 3
Surface Area 314.97 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(2-methyl-1-oxopropoxy)-2-benzothiopheno[2,3-d]furancarboxylic acid methyl ester
  • 3-isobutyryloxybenzothiopheno[2,3-d]furan-2-carboxylic acid methyl ester
  • methyl 3-(2-methylpropanoyloxy)-[1]benzothiolo[2,3-d]furan-2-carboxylate
  • methyl 3-(2-methylpropanoyloxy)benzothiopheno[2,3-d]furan-2-carboxylate
  • oprea1_823161
InChIKey STCBJZIZCOASHY-UHFFFAOYSA-N
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