4-methylphenyl [2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamate
Chemical Structure Depiction of
4-methylphenyl [2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamate
4-methylphenyl [2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamate
Compound characteristics
| Compound ID: | 6594-0017 |
| Compound Name: | 4-methylphenyl [2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamate |
| Molecular Weight: | 339.27 |
| Molecular Formula: | C16 H12 F3 N O4 |
| Smiles: | Cc1ccc(cc1)OC(NC1(C(F)(F)F)Oc2ccccc2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2666 |
| logD: | 2.0681 |
| logSw: | -4.4557 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.398 |
| InChI Key: | SWMNQRHGGAIJCQ-UHFFFAOYSA-N |