Mitoxantrone

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Properties Simple | Detailed

Formula C22H28N4O6
IUPAC Name 2-[2-[[5,8-dihydroxy-4-[2-(2-oxidoethylamino)ethylamino]-9,10-dioxo-1-anthryl]amino]ethylamino]ethanolate
Molecular Mass 444.481 g·mol−1
Heat of Formation 111743.9 ± 16.7 kJ·mol−1
Dipole Moment 72.74 ± 1.08 D
Volume 502.23 Å 3
Surface Area 455.5 Å 2
HOMO Energy -5.07 ± 0.55 eV
LUMO Energy -4.81 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4-bis(2-(2-hydroxyethylamino)ethyl)amino)-5,8-dihydroxyanthraquinone
  • 1,4-dihydroxy-5,8-bis(2-((2-hydroxyethyl)amino)ethylamino)-9,10-anthracenedione
  • 1,4-dihydroxy-5,8-bis(5-hydroxy-3-azapentylamino)anthrachinon
  • 1,4-dihydroxy-5,8-bis({2-[(2-hydroxyethyl)amino]ethyl}amino)-9,10-anthracenedione
  • 1,4-dihydroxy-5,8-bis({2-[(2-hydroxyethyl)amino]ethyl}amino)anthra-9,10-quinone
  • 1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]-9,10-anthraquinone
  • 1,4-dihydroxy-5,8-bis[[2-[(2-hydroxyethyl)amino]ethyl]amino]-9,10-anthracenedione
  • 5,8-bis((2-((2-hydroxyethyl)amino)ethyl)amino)-1,4-dihydroxyanthraquinone
  • 70476-82-3 (dihydrochloride)
  • 70711-41-0 (diacetate salt)
  • 9,10-anthracenedione, 1,4-dihydroxy-5,8-bis((2-((2-hydroxyethyl)amino)ethyl)amino)- (9ci)
  • 9,10-anthracenedione, 1,4-dihydroxy-5,8-bis[[2-[(2-hydroxyethyl)amino]ethyl] amino]-
  • 9,10-anthracenedione, 1,4-dihydroxy-5,8-bis[[2-[(2-hydroxyethyl)amino]ethyl]amino]-
  • an-584/42007670
  • anthraquinone, 5,8-bis((2-((2-hydroxyethyl)amino)ethyl)amino)-1,4-dihydroxy-
  • bpbio1_000627
  • dhaq
  • dhaq (*diacetate salt*)
  • dihydroxyanthraquinone
  • mitoxanthrone
  • mitoxantron
  • mitoxantrone (free base)
  • mitoxantrone, 1,4-dihydroxy-5,8-bis({2-[(2-hydroxyethyl)amino]ethyl}amino)anthra-9,10-quinone
  • mitozantrone
  • neuro_000153
  • smp2_000179
CAS Number(s)
  • 137635-96-2
  • 70945-62-9
InChIKey KKZJGLLVHKMTCM-UHFFFAOYSA-N
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