4-methyl-N-[2-(2,4,6-trinitrophenyl)ethyl]aniline
Chemical Structure Depiction of
4-methyl-N-[2-(2,4,6-trinitrophenyl)ethyl]aniline
4-methyl-N-[2-(2,4,6-trinitrophenyl)ethyl]aniline
Compound characteristics
Compound ID: | 0393-0121 |
Compound Name: | 4-methyl-N-[2-(2,4,6-trinitrophenyl)ethyl]aniline |
Molecular Weight: | 346.3 |
Molecular Formula: | C15 H14 N4 O6 |
Smiles: | Cc1ccc(cc1)NCCc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.928 |
logD: | 3.928 |
logSw: | -4.0816 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 109.857 |
InChI Key: | FCMHTNNNOIOVQU-UHFFFAOYSA-N |