(±)-P-[[(E)-2-Oxocyclohexylidene]Methyl]Hydratropic Acid
Properties
| Property | Value |
|---|---|
| Formula | C16H18O3 |
| IUPAC Name | (2s)-2-[4-[(e)-(2-oxocyclohexylidene)methyl]phenyl]propanoic acid |
| Molecular Mass | 258.312 g·mol−1 |
| Heat of Formation | -487.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.09 ± 1.08 D |
| Volume | 319.53 Å 3 |
| Surface Area | 290.52 Å 2 |
| HOMO Energy | -9.63 ± 0.55 eV |
| LUMO Energy | -0.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AUZUGWXLBGZUPP-IWQAVIMZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |