9-(2-Bromoethyl)-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C7H8BrN5
IUPAC Name 9-(2-bromoethyl)purin-9-ium-6-amine
Molecular Mass 242.076 g·mol−1
Heat of Formation 262.0 ± 16.7 kJ·mol−1
Dipole Moment 2.13 ± 1.08 D
Volume 220.77 Å 3
Surface Area 215.59 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
Synonyms
  • 9-(2-bromoethyl)-6-purinamine
  • 9-(2-bromoethyl)adenine
  • 9-(2-bromoethyl)purin-6-amine
  • 9h-purin-6-amine, 9-(2-bromoethyl)-
  • [9-(2-bromoethyl)purin-6-yl]amine
CAS Number(s)
  • 68217-74-3
InChIKey XWQMXSNGFXQZDR-UHFFFAOYSA-N
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Elements H C Br N