4-methyl-2-{[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]amino}phenol
Chemical Structure Depiction of
4-methyl-2-{[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]amino}phenol
4-methyl-2-{[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]amino}phenol
Compound characteristics
| Compound ID: | 8005-6009 |
| Compound Name: | 4-methyl-2-{[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]amino}phenol |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C15 H12 N2 O5 |
| Smiles: | Cc1ccc(c(c1)/N=C/c1cc2c(cc1[N+]([O-])=O)OCO2)O |
| Stereo: | ACHIRAL |
| logP: | 3.4272 |
| logD: | 3.1357 |
| logSw: | -3.4477 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.412 |
| InChI Key: | HLMCVCSRGPGONN-UHFFFAOYSA-N |