7-Amino-4-Trifluoromethylcoumarin

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Properties Simple | Detailed

Formula C10H6F3NO2
IUPAC Name 7-amino-4-(trifluoromethyl)chromen-2-one
Molecular Mass 229.155 g·mol−1
Heat of Formation -814.9 ± 16.7 kJ·mol−1
Dipole Moment 6.47 ± 1.08 D
Volume 226.16 Å 3
Surface Area 215.91 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry Cs
Synonyms
  • 2h-1-benzopyran-2-one, 7-amino-4-(trifluoromethyl)-
  • 7-amino-4-(trifluoromethyl)-2-benzopyrone
  • 7-amino-4-(trifluoromethyl)-2-chromenone
  • 7-amino-4-(trifluoromethyl)-2h-chromen-2-one
  • 7-amino-4-(trifluoromethyl)coumarin
  • ae-641/01079032
  • coumarin 151
  • sdccgmls-0021390.p002
CAS Number(s)
  • 53518-15-3
InChIKey JBNOVHJXQSHGRL-UHFFFAOYSA-N
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