[4-(2H-1,3-benzodioxol-5-yl)-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methyl acetate
Chemical Structure Depiction of
[4-(2H-1,3-benzodioxol-5-yl)-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methyl acetate
[4-(2H-1,3-benzodioxol-5-yl)-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methyl acetate
Compound characteristics
| Compound ID: | 5212-0620 |
| Compound Name: | [4-(2H-1,3-benzodioxol-5-yl)-6,8,9-trimethyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methyl acetate |
| Molecular Weight: | 358.43 |
| Molecular Formula: | C21 H26 O5 |
| Smiles: | CC1C=C(C)C2C(C)C1(COC2c1ccc2c(c1)OCO2)COC(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7428 |
| logD: | 3.7428 |
| logSw: | -4.0555 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.394 |
| InChI Key: | OTAZKNLOTKUEQR-UHFFFAOYSA-N |