2,4,6-Trihydroxy-3-Nitro-N-Octylbenzamide

Molecule SVG Image

Properties Simple | Detailed

Formula C15H22N2O6
IUPAC Name 2,4,6-trihydroxy-3-nitro-n-octyl-benzamide
Molecular Mass 326.345 g·mol−1
Heat of Formation -860.2 ± 16.7 kJ·mol−1
Dipole Moment 5.14 ± 1.08 D
Volume 384.73 Å 3
Surface Area 319.83 Å 2
HOMO Energy -10.05 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4,6-trihydroxy-3-nitro-n-octyl-benzamide
  • benzamide, 2,4,6-trihydroxy-3-nitro-n-octyl-
  • n-octyl-3-nitro-2,4,6-trihydroxybenzamide
  • pno8 cpd
CAS Number(s)
  • 126395-22-0
InChIKey GHKVBXWBMCWZKD-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N