N-(2,4-Dichlorobenzoyl)-N-[3-(Trifluoromethyl)Benzyl]-L-Phenylalanine

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Properties Simple | Detailed

Formula C24H18Cl2F3NO3
IUPAC Name (2s)-2-[(2,4-dichlorobenzoyl)-[[3-(trifluoromethyl)phenyl]methyl]amino]-3-phenyl-propanoic acid
Molecular Mass 496.306 g·mol−1
Heat of Formation -1032.5 ± 16.7 kJ·mol−1
Dipole Moment 1.83 ± 1.08 D
Volume 529.29 Å 3
Surface Area 400.33 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[(2,4-dichloro-benzoyl)-(3-trifluoromethyl-benzyl)-amino]-3-phenyl-propionic acid
  • (2s)-2-[(2,4-dichloro-benzoyl)-(3-trifluoromethylbenzyl)-amino]-3-phenyl-propionic acid
  • (2s)-2-[(2,4-dichlorobenzoyl)-[3-(trifluoromethyl)benzyl]amino]-3-phenyl-propionic acid
  • (2s)-2-[(2,4-dichlorobenzoyl)-[[3-(trifluoromethyl)phenyl]methyl]amino]-3-phenyl-propanoic acid
  • (2s)-2-[(2,4-dichlorobenzoyl)-[[3-(trifluoromethyl)phenyl]methyl]amino]-3-phenylpropanoic acid
  • (2s)-2-[(2,4-dichlorophenyl)carbonyl-[[3-(trifluoromethyl)phenyl]methyl]amino]-3-phenyl-propanoic acid
  • (2s)-2-[[(2,4-dichlorophenyl)-oxomethyl]-[[3-(trifluoromethyl)phenyl]methyl]amino]-3-phenylpropanoic acid
  • l-phenylalanine, n-(2,4-dichlorobenzoyl)-n-[[3-(trifluoromethyl)phenyl]methyl]-
InChIKey LAJJKGIZTCCOHY-NRFANRHFSA-N
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Elements C Cl H F O N