Methyl 4-Methyl-3-[(N-Propyl-L-Alanyl)Amino]-2-Thiophenecarboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C13H20N2O3S
IUPAC Name methyl 4-methyl-3-[[(2s)-2-(propylamino)propanoyl]amino]thiophene-2-carboxylate
Molecular Mass 284.375 g·mol−1
Heat of Formation -516.9 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 348.27 Å 3
Surface Area 315.87 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methyl-3-[[(2s)-1-oxo-2-propylaminopropyl]amino]-2-thiophenecarboxylic acid methyl ester
  • 4-methyl-3-[[(2s)-2-propylaminopropanoyl]amino]thiophene-2-carboxylic acid methyl ester
  • methyl 4-methyl-3-[[(2s)-2-propylaminopropanoyl]amino]thiophene-2-carboxylate
InChIKey QTGIAADRBBLJGA-VIFPVBQESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N