Ethyl (6R)-6-[(2-Chloro-4-Fluorophenyl)Sulfamoyl]-1-Cyclohexene-1-Carboxylate

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Properties Simple | Detailed

Formula C15H17ClFNO4S
IUPAC Name ethyl (6r)-6-[(2-chloro-4-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylate
Molecular Mass 361.816 g·mol−1
Heat of Formation -854.6 ± 16.7 kJ·mol−1
Dipole Moment 4.77 ± 1.08 D
Volume 380.5 Å 3
Surface Area 317.48 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
Synonyms
  • (6r)-6-[(2-chloro-4-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylic acid ethyl ester
  • (6r)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]-1-cyclohexenecarboxylic acid ethyl ester
  • ethyl (6r)-6-[(2-chloro-4-fluoro-phenyl)sulfamoyl]cyclohexene-1-carboxylate
  • ethyl (6r)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]cyclohexene-1-carboxylate
InChIKey LEEIJTHMHDMWLJ-CQSZACIVSA-N
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Elements C F H Cl O N S