4-Amino-5-Bromopyrimidin-2-Ol

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Properties Simple | Detailed

Formula C4H4BrN3O
IUPAC Name 6-amino-5-bromo-pyrimidin-2-one
Molecular Mass 189.998 g·mol−1
Heat of Formation -40.0 ± 16.7 kJ·mol−1
Dipole Moment 6.91 ± 1.08 D
Volume 152.38 Å 3
Surface Area 157.04 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry Cs
Synonyms
  • 2(1h)-pyrimidinone, 4-amino-5-bromo-
  • 4-amino-5-bromo-2-hydroxypyrimidine
  • 4-amino-5-bromo-3h-pyrimidin-2-one
  • 5-bromocytosine
CAS Number(s)
  • 2240-25-7
InChIKey QFVKLKDEXOWFSL-UHFFFAOYSA-N
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Elements H C O Br N