2,5-Bis(2-Hydroxyethylamino)-3,6-Diaziridinyl-1,4-Benzoquinone

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Properties Simple | Detailed

Formula C14H20N4O4
IUPAC Name 2,5-bis(aziridin-1-yl)-3,6-bis(2-hydroxyethylamino)-1,4-benzoquinone
Molecular Mass 308.333 g·mol−1
Heat of Formation -247.7 ± 16.7 kJ·mol−1
Dipole Moment 1.55 ± 1.08 D
Volume 361.53 Å 3
Surface Area 312.03 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry C1
Synonyms
  • 2,5-bis(1-aziridinyl)-3,6-bis(2-hydroxyethylamino)-1,4-benzoquinone
  • 2,5-bis(aziridin-1-yl)-3,6-bis(2-hydroxyethylamino)cyclohexa-2,5-diene-1,4-dione
  • 2,5-bzq
  • 2,5-cyclohexadiene-1,4-dione, 2,5-bis(1-aziridinyl)-3,6-bis((2-hydroxyethyl)amino)-
  • 2,5-cyclohexadiene-1,4-dione, 2,5-bis(1-aziridinyl)-3,6-bis[(2-hydroxyethyl)amino]-
  • 2,5-diaziridinyl-3,6-bis(2-hydroxyethylamino)-1,4-benzoquinone
  • 2,5-diethylenimino-3,6-bis(2-hydroxyethylamino)-p-benzoquinone
  • 3,6-bis((2-hydroxyethyl)amino)-2,5-diaziridinyl-1,4-benzoquinone
  • aziridinyl benzoquinone
CAS Number(s)
  • 59886-54-3
InChIKey MXNZCIQNSJMZST-UHFFFAOYSA-N
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