4-(3-Chloro-4-{[(2,4-Dichlorobenzoyl)Carbamoyl]Amino}Phenoxy)Butanoic Acid

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Properties Simple | Detailed

Formula C18H15Cl3N2O5
IUPAC Name 4-[3-chloro-4-[(2,4-dichlorobenzoyl)carbamoylamino]phenoxy]butanoic acid
Molecular Mass 445.681 g·mol−1
Heat of Formation -856.5 ± 16.7 kJ·mol−1
Dipole Moment 2.75 ± 1.08 D
Volume 465.07 Å 3
Surface Area 421.46 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 1.69 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[3-chloro-4-({[(2,4-dichlorobenzoyl)amino]carbonyl}amino)phenoxy]butanoic acid
  • 4-[3-chloro-4-[(2,4-dichlorobenzoyl)carbamoylamino]phenoxy]butyric acid
  • 4-[3-chloro-4-[(2,4-dichlorophenyl)carbonylcarbamoylamino]phenoxy]butanoic acid
  • 4-[3-chloro-4-[[[[(2,4-dichlorophenyl)-oxomethyl]amino]-oxomethyl]amino]phenoxy]butanoic acid
  • 4-{3-chloro-4-[3-(2,4-dichloro-benzoyl)-ureido]-phenoxy}-butyric acid
  • bn3
InChIKey FYQVFMLCZJZZEM-UHFFFAOYSA-N
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Elements H C N O Cl