6-methoxy-2H-1,3-benzodioxole-5-carbaldehyde
Chemical Structure Depiction of
6-methoxy-2H-1,3-benzodioxole-5-carbaldehyde
6-methoxy-2H-1,3-benzodioxole-5-carbaldehyde
Compound characteristics
| Compound ID: | 5777-0010 |
| Compound Name: | 6-methoxy-2H-1,3-benzodioxole-5-carbaldehyde |
| Molecular Weight: | 180.16 |
| Molecular Formula: | C9 H8 O4 |
| Smiles: | COc1cc2c(cc1C=O)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 1.4565 |
| logD: | 1.4565 |
| logSw: | -1.4137 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.144 |
| InChI Key: | NCIYDDIPUGCVKX-UHFFFAOYSA-N |