N,N-Bis(2-Chloroethyl)-2-Phthalimidoethylamine

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Properties Simple | Detailed

Formula C14H16Cl2N2O2
IUPAC Name 2-[2-[bis(2-chloroethyl)amino]ethyl]isoindoline-1,3-dione
Molecular Mass 315.195 g·mol−1
Heat of Formation -289.0 ± 16.7 kJ·mol−1
Dipole Moment 5.47 ± 1.08 D
Volume 359.98 Å 3
Surface Area 324.32 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -1.50 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-isoindole-1,3(2h)-dione, 2-(2-(bis(2-chloroethyl)amino)ethyl)-
  • 2-[2-[bis(2-chloroethyl)amino]ethyl]isoindole-1,3-dione
  • 2-[2-[bis(2-chloroethyl)amino]ethyl]isoindoline-1,3-quinone
  • phthalmustine
CAS Number(s)
  • 156250-83-8
InChIKey WBSOXOXZQOTHHV-UHFFFAOYSA-N
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