2-{[5-(Diethylamino)[1,2,4]Triazolo[1,5-A]Pyrimidin-7-Yl](Hexyl)Amino}Ethanol

Molecule SVG Image

Properties Simple | Detailed

Formula C17H30N6O
IUPAC Name 2-[(5-diethylamino-[1,2,4]triazolo[5,1-b]pyrimidin-7-yl)-hexylamino]ethanol
Molecular Mass 334.460 g·mol−1
Heat of Formation 8.3 ± 16.7 kJ·mol−1
Dipole Moment 7.89 ± 1.08 D
Volume 439.34 Å 3
Surface Area 381.43 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(5-diethylamino-[1,2,4]triazolo[5,1-b]pyrimidin-7-yl)-hexyl-amino]ethanol
  • ar 12456
  • ar-12-456
  • ethanol, 2-((5-(diethylamino)(1,2,4)triazolo(1,5-a)pyrimidin-7-yl)hexylamino)-
CAS Number(s)
  • 100557-06-0
InChIKey NWCVGIMEZSWINX-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N