2-[(3,4-Dichlorobenzyl)Sulfanyl]-4-(4-Hydroxy-1-Butyn-1-Yl)Benzoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C18H14Cl2O3S |
| IUPAC Name | 2-[(3,4-dichlorophenyl)methylsulfanyl]-4-(4-hydroxybut-1-ynyl)benzoic acid |
| Molecular Mass | 381.273 g·mol−1 |
| Heat of Formation | -226.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.67 ± 1.08 D |
| Volume | 415.08 Å 3 |
| Surface Area | 384.31 Å 2 |
| HOMO Energy | -8.79 ± 0.55 eV |
| LUMO Energy | -1.39 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LYKDQGOGGHKHLP-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O Cl |