(2-Amino-4,5-Dimethyl-3-Thienyl)[3-(Trifluoromethyl)Phenyl]Methanone

Molecule SVG Image

Properties Simple | Detailed

Formula C14H12F3NOS
IUPAC Name (2-amino-4,5-dimethyl-3-thienyl)-[3-(trifluoromethyl)phenyl]methanone
Molecular Mass 299.311 g·mol−1
Heat of Formation -695.5 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 321.69 Å 3
Surface Area 284.24 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
Synonyms
  • (2-amino-4,5-dimethyl-thiophen-3-yl)-[3-(trifluoromethyl)phenyl]methanone
  • methanone, (2-amino-4,5-dimethyl-3-thienyl)(3-(trifluoromethyl)phenyl)-
  • pd 81723
  • pd81723
  • tocris-1363
CAS Number(s)
  • 132861-87-1
InChIKey KKDKAWKYGCUOGR-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S