6-Methoxy-4-Phenyl-1-(2,2,2-Trifluoroethyl)-2(1H)-Quinazolinone

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Properties Simple | Detailed

Formula C17H13F3N2O2
IUPAC Name 6-methoxy-4-phenyl-1-(2,2,2-trifluoroethyl)quinazolin-2-one
Molecular Mass 334.293 g·mol−1
Heat of Formation -690.8 ± 16.7 kJ·mol−1
Dipole Moment 7.47 ± 1.08 D
Volume 356.19 Å 3
Surface Area 317.78 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
Synonyms
  • 2(1h)-quinazolinone, 6-methoxy-4-phenyl-1-(2,2,2-trifluoroethyl)-
  • 6-methoxy-4-phenyl-1-(2,2,2-trifluoroethyl)-2-(1h)-quinazolinone
  • 6-methoxy-4-phenyl-1-(2,2,2-trifluoroethyl)-2-quinazolinone
  • moptfeq
CAS Number(s)
  • 49830-89-9
InChIKey MZGQIBQVSJDWHM-UHFFFAOYSA-N
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