N-(3-bromo-4-methylphenyl)-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
Chemical Structure Depiction of
N-(3-bromo-4-methylphenyl)-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
N-(3-bromo-4-methylphenyl)-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
Compound characteristics
| Compound ID: | 8006-5313 |
| Compound Name: | N-(3-bromo-4-methylphenyl)-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine |
| Molecular Weight: | 363.16 |
| Molecular Formula: | C15 H11 Br N2 O4 |
| Smiles: | Cc1ccc(cc1[Br])/N=C/c1cc2c(cc1[N+]([O-])=O)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.4976 |
| logD: | 4.4974 |
| logSw: | -4.4809 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.562 |
| InChI Key: | QVTHQWAEKCBYGN-UHFFFAOYSA-N |