(5-Fluoro-12-Methyl-7-Tetraphenyl)Methyl Acetate

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Properties Simple | Detailed

Formula C22H17FO2
IUPAC Name (5-fluoro-12-methyl-benzo[a]anthracen-7-yl)methyl acetate
Molecular Mass 332.368 g·mol−1
Heat of Formation -280.6 ± 16.7 kJ·mol−1
Dipole Moment 4.12 ± 1.08 D
Volume 384.33 Å 3
Surface Area 337.67 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -1.26 ± eV
Point Group Symmetry C1
Synonyms
  • (5-fluoro-12-methyl-benzo[b]phenanthren-7-yl)methyl acetate
  • (5-fluoro-12-methyl-benzo[b]phenanthren-7-yl)methyl ethanoate
  • (5-fluoro-12-methylbenzo[a]anthracen-7-yl)methyl acetate
  • (5-fluoro-12-methylbenzo[b]phenanthren-7-yl)methyl acetate
  • 5-fluoro-7-hydroxymethyl 12-methylbenzanthracene acetate
  • 5-fluoro-7-hydroxymethyl-12-methylbenz(a)anthracene acetate
  • acetic acid (5-fluoro-12-methyl-benzo[b]phenanthren-7-yl)methyl ester
  • benz(a)anthracene-7-methanol, 5-fluoro-12-methyl-, acetate
CAS Number(s)
  • 67639-46-7
InChIKey BWBNQGMPRXNAEL-UHFFFAOYSA-N
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