(2R)-6,7-Dichloro-5-(Dimethylsulfamoyl)-2,3-Dihydro-1-Benzofuran-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C11H11Cl2NO5S
IUPAC Name (2r)-6,7-dichloro-5-(dimethylsulfamoyl)-2,3-dihydrobenzofuran-2-carboxylic acid
Molecular Mass 340.180 g·mol−1
Heat of Formation -799.7 ± 16.7 kJ·mol−1
Dipole Moment 5.26 ± 1.08 D
Volume 331.04 Å 3
Surface Area 288.11 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-6,7-dichloro-5-(dimethylsulfamoyl)-2,3-dihydrobenzofuran-2-carboxylic acid
  • (r)-2,3-dihydro-6,7-dichloro-5-((dimethylamino)sulfonyl)-2-benzofurancarboxylic acid
  • 2-benzofurancarboxylic acid, 2,3-dihydro-6,7-dichloro-5-((dimethylamino)sulfonyl)-, (r)-
  • s-8666 (+)
CAS Number(s)
  • 108940-98-3
InChIKey ZTFUDCAAHOVUPH-ZCFIWIBFSA-N
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