2-(3,4-dimethoxyphenyl)-2-oxoethyl thiocyanate
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-2-oxoethyl thiocyanate
2-(3,4-dimethoxyphenyl)-2-oxoethyl thiocyanate
Compound characteristics
| Compound ID: | 8011-8027 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-2-oxoethyl thiocyanate |
| Molecular Weight: | 237.27 |
| Molecular Formula: | C11 H11 N O3 S |
| Smiles: | COc1ccc(cc1OC)C(CSC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6278 |
| logD: | 1.6278 |
| logSw: | -2.2844 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.543 |
| InChI Key: | WAIJFLLFDYMRFP-UHFFFAOYSA-N |