(2R,2As,4As,7As,7Br)-2-[(2,4-Dihydroxy-6-Methylbenzoyl)Oxy]-2A-Hydroxy-6,6,7B-Trimethyl-2,2A,4A,5,6,7,7A,7B-Octahydro-1H-Cyclobuta[E]Indene-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C23H28O7 |
| IUPAC Name | (2r,2as,4as,7as,7br)-2-(2,4-dihydroxy-6-methyl-benzoyl)oxy-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]indene-3-carboxylic acid |
| Molecular Mass | 416.464 g·mol−1 |
| Heat of Formation | -1291.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.90 ± 1.08 D |
| Volume | 484.33 Å 3 |
| Surface Area | 372.91 Å 2 |
| HOMO Energy | -9.49 ± 0.55 eV |
| LUMO Energy | -0.38 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AOCKXACXCVTXBB-BLSXBMPJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |