Terflavoxate

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Properties Simple | Detailed

Formula C26H30NO4+
IUPAC Name [1,1-dimethyl-2-(1-piperidyl)ethyl] 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate
Molecular Mass 420.521 g·mol−1
Heat of Formation -516.4 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 516.36 Å 3
Surface Area 426.38 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (2-methyl-1-piperidin-1-yl-propan-2-yl) 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate
  • (2-methyl-1-piperidin-1-ylpropan-2-yl) 3-methyl-4-oxo-2-phenylchromene-8-carboxylate
  • 3-methyl-4-oxo-2-phenyl-8-chromenecarboxylic acid [1,1-dimethyl-2-(1-piperidyl)ethyl] ester
  • 4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid (1,1-dimethyl-2-piperidino-ethyl) ester
CAS Number(s)
  • 86433-40-1
InChIKey VQTYZZPDAFGNCK-UHFFFAOYSA-N
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