({5-[2-Chloro-4-(Trifluoromethyl)Phenoxy]-2-Nitrobenzoyl}Oxy)Acetic Acid

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Properties Simple | Detailed

Formula C16H9ClF3NO7
IUPAC Name 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoyl]oxyacetic acid
Molecular Mass 419.693 g·mol−1
Heat of Formation -1363.6 ± 16.7 kJ·mol−1
Dipole Moment 4.92 ± 1.08 D
Volume 410.38 Å 3
Surface Area 342.01 Å 2
HOMO Energy -10.23 ± 0.55 eV
LUMO Energy -1.72 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbonyloxyethanoic acid
  • 2-[[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]-oxomethoxy]acetic acid
  • 5-((2-chloro-alpha,alpha,alpha-trifluoro-p-tolyl)oxy)-2-nitrobenzoic acid ester with glycolic acid
  • benzoic acid, 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitro-, carboxymethyl ester
  • carboxymethyl 5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrobenzoate
  • fluoroglicofene [iso-french]
  • fluoroglycofen [ansi:bsi:iso]
  • o-(5-(2-chloro-alpha,alpha,alpha-trifluoro-p-tolyloxy)-2-nitrobenzoyl)glycolic acid
CAS Number(s)
  • 77501-60-1
  • 118340-11-7
InChIKey DHAHEVIQIYRFRG-UHFFFAOYSA-N
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Elements C F H Cl O N