(2S)-3,3,3-Trifluoro-2-Hydroxy-2-Methyl-N-[4-(Phenylsulfonyl)Phenyl]Propanamide

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Properties Simple | Detailed

Formula C16H14F3NO4S
IUPAC Name (2s)-n-[4-(benzenesulfonyl)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methyl-propanamide
Molecular Mass 373.347 g·mol−1
Heat of Formation -1171.1 ± 16.7 kJ·mol−1
Dipole Moment 7.17 ± 1.08 D
Volume 389.65 Å 3
Surface Area 343.19 Å 2
HOMO Energy -9.78 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3,3,3-trifluoro-2-hydroxy-2-methyl-n-(4-phenylsulfonylphenyl)propanamide
  • (2s)-3,3,3-trifluoro-2-hydroxy-2-methyl-n-(4-phenylsulfonylphenyl)propionamide
  • tocris-0882
InChIKey LJLXQHHFAKVTNP-HNNXBMFYSA-N
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