2,4,6-trinitro-N-[1-(4-nitrophenyl)ethyl]aniline
Chemical Structure Depiction of
2,4,6-trinitro-N-[1-(4-nitrophenyl)ethyl]aniline
2,4,6-trinitro-N-[1-(4-nitrophenyl)ethyl]aniline
Compound characteristics
Compound ID: | 0920-0299 |
Compound Name: | 2,4,6-trinitro-N-[1-(4-nitrophenyl)ethyl]aniline |
Molecular Weight: | 377.27 |
Molecular Formula: | C14 H11 N5 O8 |
Smiles: | CC(c1ccc(cc1)[N+]([O-])=O)Nc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1363 |
logD: | 3.0708 |
logSw: | -3.3672 |
Hydrogen bond acceptors count: | 16 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 141.165 |
InChI Key: | DSFKHWCXCVDYDL-QMMMGPOBSA-N |