P,P-Bis(1-Aziridinyl)-N-[(5-Methoxy-2-Pyrimidinyl)Carbamoyl]Phosphinic Amide

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Properties Simple | Detailed

Formula C10H15N6O3P
IUPAC Name 1-[bis(aziridin-1-yl)phosphoryl]-3-(5-methoxypyrimidin-2-yl)urea
Molecular Mass 298.238 g·mol−1
Heat of Formation -188.8 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 331.33 Å 3
Surface Area 306.77 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(bis(1-aziridinyl)phosphinyl)-3-(5-methoxy-2-pyrimidinyl)urea
  • 1-[bis(1-aziridinyl)phosphoryl]-3-(5-methoxy-2-pyrimidinyl)urea
  • 1-diethyleniminophosphoryl-3-(5-methoxypyrimidin-2-yl)urea
  • ederpin
  • ederpine
  • n-diethyleneamidophosphono-n'-5-methoxypyrimidyl-2-urea
  • preparation 631
  • urea, 1-(bis(1-aziridinyl)phosphinyl)-3-(5-methoxy-2-pyrimidinyl)-
  • urea, n-(bis(1-aziridinyl)phosphinyl)-n'-(5-methoxy-2-pyrimidinyl)- (9ci)
CAS Number(s)
  • 25635-68-1
InChIKey DQRQBRDDSALHQM-UHFFFAOYSA-N
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