methyl [2-(trichloromethyl)-2H-1,3-benzodioxol-2-yl]carbamate
Chemical Structure Depiction of
methyl [2-(trichloromethyl)-2H-1,3-benzodioxol-2-yl]carbamate
methyl [2-(trichloromethyl)-2H-1,3-benzodioxol-2-yl]carbamate
Compound characteristics
| Compound ID: | 8002-6515 |
| Compound Name: | methyl [2-(trichloromethyl)-2H-1,3-benzodioxol-2-yl]carbamate |
| Molecular Weight: | 312.53 |
| Molecular Formula: | C10 H8 Cl3 N O4 |
| Smiles: | COC(NC1(C([Cl])([Cl])[Cl])Oc2ccccc2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0076 |
| logD: | 0.5497 |
| logSw: | -3.4582 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.194 |
| InChI Key: | NPOUGLLHLBGNBP-UHFFFAOYSA-N |