6-(cyclopropylmethyl)-7-nitro-2,3-dihydro-1,4-benzodioxine
Chemical Structure Depiction of
6-(cyclopropylmethyl)-7-nitro-2,3-dihydro-1,4-benzodioxine
6-(cyclopropylmethyl)-7-nitro-2,3-dihydro-1,4-benzodioxine
Compound characteristics
| Compound ID: | 8008-3501 |
| Compound Name: | 6-(cyclopropylmethyl)-7-nitro-2,3-dihydro-1,4-benzodioxine |
| Molecular Weight: | 235.24 |
| Molecular Formula: | C12 H13 N O4 |
| Smiles: | C1CC1Cc1cc2c(cc1[N+]([O-])=O)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.0829 |
| logD: | 2.0829 |
| logSw: | -2.3104 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.394 |
| InChI Key: | LMMWLAGBPVCKCX-UHFFFAOYSA-N |