Methyl (4R)-2,6-Dimethyl-5-Nitro-4-[2-(Trifluoromethyl)Phenyl]-1,4-Dihydro-3-Pyridinecarboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C16H15F3N2O4
IUPAC Name methyl (4r)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
Molecular Mass 356.297 g·mol−1
Heat of Formation -919.5 ± 16.7 kJ·mol−1
Dipole Moment 8.30 ± 1.08 D
Volume 368.06 Å 3
Surface Area 306.05 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester
  • (r)-()-bay k8644
  • methyl (4r)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
  • r-()-1,4-dihydro-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-3-pyridinecarboxylic acid methyl ester
  • tocris-1546
InChIKey ZFLWDHHVRRZMEI-CYBMUJFWSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F