(2R)-3-[(3,5-Dimethoxyphenyl)(Ethyl)Amino]-2-Hydroxy-1-Propanesulfonic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C13H21NO6S
IUPAC Name (2r)-3-(n-ethyl-3,5-dimethoxy-anilino)-2-hydroxy-propane-1-sulfonic acid
Molecular Mass 319.374 g·mol−1
Heat of Formation -1037.1 ± 16.7 kJ·mol−1
Dipole Moment 3.51 ± 1.08 D
Volume 363.91 Å 3
Surface Area 317.55 Å 2
HOMO Energy -8.28 ± 0.55 eV
LUMO Energy 0.26 ± eV
Point Group Symmetry C1
InChIKey BTIDJAQNJLWPTI-LLVKDONJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N