N-(2-Chloroethyl)-N'-(6-Chloro-2-Methoxy-9-Acridinyl)-1,3-Propanediamine

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Properties Simple | Detailed

Formula C19H21Cl2N3O
IUPAC Name n-(2-chloroethyl)-n'-(6-chloro-2-methoxy-acridin-9-yl)propane-1,3-diamine
Molecular Mass 378.296 g·mol−1
Heat of Formation -1.8 ± 16.7 kJ·mol−1
Dipole Moment 7.95 ± 1.08 D
Volume 424.94 Å 3
Surface Area 339.31 Å 2
HOMO Energy -8.19 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-propanediamine, n-(2-chloroethyl)-n'-(6-chloro-2-methoxy-9-acridinyl)-
  • 3-(2-chloroethylamino)propyl-(6-chloro-2-methoxy-acridin-9-yl)amine
  • acridine half-mustard
  • acridine, 6-chloro-9-((3-((2-chloroethyl)amino)propyl)amino)-2-methoxy-
  • n'-(2-chloroethyl)-n-(6-chloro-2-methoxy-9-acridinyl)propane-1,3-diamine
  • n'-(2-chloroethyl)-n-(6-chloro-2-methoxy-acridin-9-yl)propane-1,3-diamine
  • n'-(2-chloroethyl)-n-(6-chloro-2-methoxyacridin-9-yl)propane-1,3-diamine
InChIKey OAPNFEMIOBGOHM-UHFFFAOYSA-N
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Elements H C N O Cl