2-Propyl-1-{[2'-(2H-Tetrazol-5-Yl)-4-Biphenylyl]Methyl}-4-(Trifluoromethyl)-1H-Imidazole-5-Carboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C22H19F3N6O2
IUPAC Name 2-propyl-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]-5-(trifluoromethyl)imidazole-4-carboxylic acid
Molecular Mass 456.420 g·mol−1
Heat of Formation -431.6 ± 16.7 kJ·mol−1
Dipole Moment 7.13 ± 1.08 D
Volume 516.59 Å 3
Surface Area 401.09 Å 2
HOMO Energy -9.98 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-imidazole-5-carboxylic acid, 2-propyl-1-((2'-(1h-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-4-(trifluoromethyl)-
  • 2-n-propyl-4-trifluoromethyl-1-((2'-(tetrazol-5-yl)biphenyl-4-yl)methyl)imidizole-5-carboxylic acid
  • 2-propyl-3-[4-[2-(2h-tetrazol-5-yl)phenyl]benzyl]-5-(trifluoromethyl)imidazole-4-carboxylic acid
  • 2-propyl-3-[[4-[2-(2h-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-5-(trifluoromethyl)imidazole-4-carboxylic acid
  • 2-propyl-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]-5-(trifluoromethyl)-4-imidazolecarboxylic acid
  • exp 3892
  • exp3892
CAS Number(s)
  • 124750-93-2
InChIKey VDRAEBDTPFEPFP-UHFFFAOYSA-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