6-[(2-Aminoethyl)Amino]-5-Chloro-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C6H9ClN4O2
IUPAC Name 6-(2-aminoethylamino)-5-chloro-1h-pyrimidine-2,4-dione
Molecular Mass 204.614 g·mol−1
Heat of Formation -334.6 ± 16.7 kJ·mol−1
Dipole Moment 8.46 ± 1.08 D
Volume 215.77 Å 3
Surface Area 215.35 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.59 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4(1h,3h)-pyrimidinedione,6-[(2-aminoethyl)amino]-5-chloro-
  • 6-(2-aminoethyl)amino-5-chlorouracil
  • 6-(2-aminoethylamino)-5-chloro-uracil
CAS Number(s)
  • 399550-08-4
InChIKey UBIZYYDQUSJYIT-UHFFFAOYSA-N
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Elements H C N O Cl