3-Methylcholanthrene

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Properties Simple | Detailed

Formula C21H16
IUPAC Name 3-methyl-1,2-dihydrobenzo[j]aceanthrylene
Molecular Mass 268.352 g·mol−1
Heat of Formation 264.0 ± 16.7 kJ·mol−1
Dipole Moment 1.65 ± 1.08 D
Volume 326.14 Å 3
Surface Area 292.63 Å 2
HOMO Energy -8.12 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,2-dihydro-3-methylbenz(j)aceanthrylene
  • 20-mc
  • 20-methylcholanthrene
  • 3-mc
  • 3-mca
  • 3-mch
  • 3-meca
  • 3-methoxycholanthrene
  • 3-methyl-1,2-dihydrocyclopenta[ij]tetraphene
  • 3-methyl-i,j-cyclopentabenz(a)anthracene
  • 3-methylbenz(j)aceanthrene
  • 3-methylchloanthrene
  • 3-methylcholanthrene solution
  • 3-methylcyclopentabenzophenanthrene
  • benz(j)aceanthrylene, 1,2-dihydro-3-methyl-
  • benz[j]aceanthrylene, 1,2-dihydro-3-methyl-
  • cholanthrene, 3-methyl-
  • mc
  • mca
  • methylcholanthrene
CAS Number(s)
  • 56-49-5
  • 345299-31-2
InChIKey PPQNQXQZIWHJRB-UHFFFAOYSA-N
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Elements H C