2-(4-Methoxybenzyl)-3,4-Dimethylpyrano[2,3-C]Pyrazol-6(2H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C16H16N2O3
IUPAC Name 2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-pyrano[2,3-c]pyrazol-6-one
Molecular Mass 284.310 g·mol−1
Heat of Formation -177.2 ± 16.7 kJ·mol−1
Dipole Moment 8.35 ± 1.08 D
Volume 334.94 Å 3
Surface Area 302.6 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4'-methoxyphenylmethyl)-3,4-dimethylpyrano(2,3-c)pyrazol-6(2h)-one
  • 2-(4-methoxybenzyl)-3,4-dimethyl-pyrano[6,5-c]pyrazol-6-one
  • 2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-6-pyrano[6,5-c]pyrazolone
  • 2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-pyrano[6,5-c]pyrazol-6-one
  • 2-[(4-methoxyphenyl)methyl]-3,4-dimethylpyrano[6,5-c]pyrazol-6-one
  • ha 22
  • ha-22
  • pyrano(2,3-c)pyrazol-6(2h)-one, 3,4-dimethyl-2-((4-methoxyphenyl)methyl)-
CAS Number(s)
  • 144092-63-7
InChIKey JSKLXDBRUMMHQV-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