(3R,4R,5Z)-3-[(7-Chloro-1,3-Benzodioxol-5-Yl)Methyl]-4-Hydroxy-4-Isopropyl-5-(4-Methoxybenzylidene)Dihydro-2(3H)-Furanone
Properties
Property | Value |
---|---|
Formula | C23H23ClO6 |
IUPAC Name | (3r,4s,5z)-3-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-4-hydroxy-4-isopropyl-5-[(4-methoxyphenyl)methylene]tetrahydrofuran-2-one |
Molecular Mass | 430.878 g·mol−1 |
Heat of Formation | -799.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.84 ± 1.08 D |
Volume | 487.47 Å 3 |
Surface Area | 416.88 Å 2 |
HOMO Energy | -8.49 ± 0.55 eV |
LUMO Energy | -0.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | YYPUQBCQRSMSKU-KYAGZVBCSA-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 |