6-Amino-1H-Purin-1-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C5H6N5O+
IUPAC Name 1-hydroxypurin-1-ium-6-ylium-6-amine
Molecular Mass 152.134 g·mol−1
Heat of Formation 342.7 ± 16.7 kJ·mol−1
Dipole Moment 9.42 ± 1.08 D
Volume 161.47 Å 3
Surface Area 163.85 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 1.54 ± eV
Point Group Symmetry C1
Synonyms
  • (1-hydroxypurin-6-yl)amine
  • 1-hydroxy-6-purinamine
  • 1-hydroxypurin-6-amine
  • 1h-purin-6-amine, 1-oxide
  • 1h-purin-6-amine, 1-oxide (9ci)
  • adenine 1-n-oxide
  • adenine 1-oxide
  • adenine, 1-n-oxide
  • adenine, 1-oxide
  • adenine-n-oxide
CAS Number(s)
  • 700-02-7
InChIKey FSEXIIUMRZGIDN-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N