(2R,2As,4As,7As,7Br)-3-Formyl-2A-Hydroxy-6,6,7B-Trimethyl-2,2A,4A,5,6,7,7A,7B-Octahydro-1H-Cyclobuta[E]Inden-2-Yl 3-Chloro-6-Hydroxy-4-Methoxy-2-Methylbenzoate
Properties
| Property | Value |
|---|---|
| Formula | C24H29ClO6 |
| IUPAC Name | [(2r,2ar,4ar,7ar,7bs)-3-formyl-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 3-chloro-6-hydroxy-4-methoxy-2-methyl-benzoate |
| Molecular Mass | 448.936 g·mol−1 |
| Heat of Formation | -1035.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.97 ± 1.08 D |
| Volume | 516.79 Å 3 |
| Surface Area | 415.45 Å 2 |
| HOMO Energy | -9.07 ± 0.55 eV |
| LUMO Energy | -0.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QETHRCCHQRWBIJ-NXWVSEADSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Cl |