Anodyne| Elemicin | |
|---|---|
 | |
| Molecular structure via molpic | |
| Conformer structure via 3Dmol.js | |
| Molecular formula | C12H16O3[1] |
| Molecular mass | 208.25 g/mol[1] |
| Density | 1.058-1.070 g/cm3[1] |
| Predicted LogP | 2.5[1] |
| Boiling point | 152.00 to 156.00 °C. @ 17.00 mm Hg[1] |
| Solubility | Practically insoluble to insoluble in water[1] |
| Chirality | achiral[2] |
| Identifiers [] | |
|---|---|
| IUPAC name | 1,2,3-trimethoxy-5-prop-2-enylbenzene[1] |
| SMILES | COC1=CC(=CC(=C1OC)OC)CC=C[1] |
| InChI | InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5,7-8H,1,6H2,2-4H3[1] |
| InChIKey | BPLQKQKXWHCZSS-UHFFFAOYSA-N[1] |
| Dosing |
|---|
Elemicin
Elemicin (also known as 5-Allyl-1,2,3-trimethoxybenzene, 3,4,5-Trimethoxyallylbenzene, Benzene, 1,2,3-trimethoxy-5-(2-propenyl)-, 1,2,3-Trimethoxy-5-(2-propenyl)benzene, CCRIS 6783, Benzene, 5-allyl-1,2,3-trimethoxy-, 4-allyl-1,2,6-trimethoxybenzene, 3,4,5-trimethoxyallyl benzene, AI3-20815 or 1,2,3-trimethoxy-5-(prop-2-en-1-yl)benzene)
Chemistry
Stereochemistry
Elemicin is a achiral mixture