2-(4-{2-[(3,5-Dichlorophenyl)Amino]-2-Oxoethyl}Phenoxy)-2-Methylpropanoic Acid

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Properties Simple | Detailed

Formula C18H17Cl2NO4
IUPAC Name 2-[4-[2-(3,5-dichloroanilino)-2-oxo-ethyl]phenoxy]-2-methyl-propanoic acid
Molecular Mass 382.238 g·mol−1
Heat of Formation -650.1 ± 16.7 kJ·mol−1
Dipole Moment 1.83 ± 1.08 D
Volume 428.62 Å 3
Surface Area 378.54 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-(2-((3,5-dichlorophenyl)amino)-2-oxoethyl)phenoxy)-2-methylpropanoic acid
  • 2-[4-[2-[(3,5-dichlorophenyl)amino]-2-keto-ethyl]phenoxy]-2-methyl-propionic acid
  • 2-[4-[2-[(3,5-dichlorophenyl)amino]-2-oxo-ethyl]phenoxy]-2-methyl-propanoic acid
  • 4-(2-(4-(((3,5-dichloroanilino)carbonyl)methyl)phenoxy)-2-methylpropionic acid)
  • propanoic acid, 2-(4-(2-((3,5-dichlorophenyl)amino)-2-oxoethyl)phenoxy)-2-methyl-
  • rsr 4
CAS Number(s)
  • 131179-94-7
InChIKey YSKMQAIZJHNDTP-UHFFFAOYSA-N
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Elements H C N O Cl