2,6-Dimethyl-3,5-Dicarbomethoxy-4-(4-Nitrophenyl)-1,4-Dihydropyridine

Molecule SVG Image

Properties Simple | Detailed

Formula C17H18N2O6
IUPAC Name dimethyl 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Mass 346.335 g·mol−1
Heat of Formation -606.1 ± 16.7 kJ·mol−1
Dipole Moment 10.07 ± 1.08 D
Volume 400.26 Å 3
Surface Area 335.96 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4-dihydro-2,6-dimethyl-4-(4-nitrophenyl)-3,5-pyridinedicarboxylic acid dimethyl ester
  • 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester
  • 3,5-pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(4-nitrophenyl)-, dimethyl ester
  • bas 01039289
  • cbdive_007732
  • dimethyl 1,4-dihydro-2,6-dimethyl-4-(4-nitrophenyl)pyridine-3,5-dicarboxylate
  • dimethyl 2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate
  • oprea1_010065
  • oprea1_510309
CAS Number(s)
  • 161838-99-9
  • 21829-09-4
InChIKey VFQXEYKTWNRSQE-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N