4-[({[2-(Dimethylcarbamoyl)Phenyl]Carbamoyl}Oxy)Methyl]Benzoic Acid

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Properties Simple | Detailed

Formula C18H18N2O5
IUPAC Name 4-[[2-(dimethylcarbamoyl)phenyl]carbamoyloxymethyl]benzoic acid
Molecular Mass 342.346 g·mol−1
Heat of Formation -718.5 ± 16.7 kJ·mol−1
Dipole Moment 4.46 ± 1.08 D
Volume 393.89 Å 3
Surface Area 363.08 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 2.21 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(2-dimethylcarbamoyl-phenylcarbamoyloxymethyl)-benzoic acid
  • 4-[[[[2-(dimethylamino-oxomethyl)phenyl]amino]-oxomethoxy]methyl]benzoic acid
  • rac
InChIKey WBKIRHATIRDZAH-UHFFFAOYSA-N
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