1-{[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl}-1H-1,2,4-triazole--nitric acid (1/1)
Chemical Structure Depiction of
1-{[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl}-1H-1,2,4-triazole--nitric acid (1/1)
1-{[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl}-1H-1,2,4-triazole--nitric acid (1/1)
Compound characteristics
| Compound ID: | 0278-0049 |
| Compound Name: | 1-{[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl}-1H-1,2,4-triazole--nitric acid (1/1) |
| Molecular Weight: | 405.24 |
| Molecular Formula: | C15 H17 Cl2 N3 O2 |
| Salt: | HNO3 |
| Smiles: | CCCC1COC(Cn2cncn2)(c2ccc(cc2[Cl])[Cl])O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7278 |
| logD: | 3.7278 |
| logSw: | -4.251 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.837 |
| InChI Key: | STJLVHWMYQXCPB-UHFFFAOYSA-N |