4-(Cyclohexylcarbamoyl)-2-(4-Methoxyphenyl)-6-Oxotetrahydro-4H-Furo[3,2-D][1,3]Dioxin-7-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C22H27NO8 |
IUPAC Name | [(2s,4s,4as,7s,7as)-4-(cyclohexylcarbamoyl)-2-(4-methoxyphenyl)-6-oxo-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-7-yl] acetate |
Molecular Mass | 433.452 g·mol−1 |
Heat of Formation | -1326.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.26 ± 1.08 D |
Volume | 497.23 Å 3 |
Surface Area | 412.92 Å 2 |
HOMO Energy | -9.06 ± 0.55 eV |
LUMO Energy | 3.09 ± eV |
Point Group Symmetry | C1 |
InChIKey | IMKOFVXQYVDISO-SHUHUVMISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |