5-(3-{[(2,4-Dichlorobenzoyl)Carbamoyl]Amino}-2-Methylphenoxy)Pentanoic Acid

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Properties Simple | Detailed

Formula C20H20Cl2N2O5
IUPAC Name 5-[3-[(2,4-dichlorobenzoyl)carbamoylamino]-2-methyl-phenoxy]pentanoic acid
Molecular Mass 439.289 g·mol−1
Heat of Formation -874.9 ± 16.7 kJ·mol−1
Dipole Moment 3.05 ± 1.08 D
Volume 485.89 Å 3
Surface Area 439.69 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy 1.68 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[3-({[(2,4-dichlorobenzoyl)amino]carbonyl}amino)-2-methylphenoxy]pentanoic acid
  • 5-[3-[(2,4-dichlorobenzoyl)carbamoylamino]-2-methyl-phenoxy]valeric acid
  • 5-[3-[(2,4-dichlorobenzoyl)carbamoylamino]-2-methylphenoxy]pentanoic acid
  • 5-[3-[(2,4-dichlorophenyl)carbonylcarbamoylamino]-2-methyl-phenoxy]pentanoic acid
  • 5-[3-[[[[(2,4-dichlorophenyl)-oxomethyl]amino]-oxomethyl]amino]-2-methylphenoxy]pentanoic acid
  • 5-{3-[3-(2,4-dichloro-benzoyl)-ureido]-2-methyl-phenoxy}-pentanoic acid
  • bn5
InChIKey NJJIFGCFUDDBSP-UHFFFAOYSA-N
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Elements H C N O Cl