(2S)-3-[Ethyl(3-Methylphenyl)Amino]-2-Hydroxy-1-Propanesulfonic Acid
Properties
Property | Value |
---|---|
Formula | C12H19NO4S |
IUPAC Name | (2s)-3-(n-ethyl-3-methyl-anilino)-2-hydroxy-propane-1-sulfonic acid |
Molecular Mass | 273.349 g·mol−1 |
Heat of Formation | -728.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.59 ± 1.08 D |
Volume | 320.69 Å 3 |
Surface Area | 286.56 Å 2 |
HOMO Energy | -8.16 ± 0.55 eV |
LUMO Energy | 0.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZTQGWROHRVYSPW-LBPRGKRZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |