(2R,4S)-6-Fluoro-2-Methyl-2,3-Dihydro-2'H,5'H-Spiro[Chromene-4,4'-Imidazolidine]-2',5'-Dione

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Properties Simple | Detailed

Formula C12H11FN2O3
IUPAC Name (2r,4s)-6-fluoro-2-methyl-spiro[chromane-4,5'-imidazolidine]-2',4'-dione
Molecular Mass 250.226 g·mol−1
Heat of Formation -616.0 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 269.34 Å 3
Surface Area 245.48 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,4s)-6-fluoro-2-methyl-spiro[chroman-4,5'-imidazolidine]-2',4'-dione
  • (2r,4s)-6-fluoro-2-methyl-spiro[chroman-4,5'-imidazolidine]-2',4'-quinone
  • (2r,4s)-6-fluoro-2-methylspiro[chroman-4,5'-imidazolidine]-2',4'-dione
  • 2-methylsorbinol
  • e 0722
  • e 0722 (pharmaceutical)
  • e 79175
  • e-0722
  • m-79175
  • methosorbinil
  • spiro(4h-1-benzopyran-4,4'-imidazolidine)-2',5'-dione, 6-fluoro-2,3-dihydro-2-methyl-, (2r,4s)-
  • spiro(4h-1-benzopyran-4,4'-imidazolidone)-2',5'-dione, 6-fluoro-2,3-dihydro-2-methyl-, (2r-cis)-
CAS Number(s)
  • 102916-95-0
InChIKey SEAQTHCVAGBRFY-INWYIAFRSA-N
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