2-(2,6-dimethyl-4-nitrophenoxy)-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(2,6-dimethyl-4-nitrophenoxy)-1-(pyrrolidin-1-yl)ethan-1-one
2-(2,6-dimethyl-4-nitrophenoxy)-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
Compound ID: | 8018-3496 |
Compound Name: | 2-(2,6-dimethyl-4-nitrophenoxy)-1-(pyrrolidin-1-yl)ethan-1-one |
Molecular Weight: | 278.31 |
Molecular Formula: | C14 H18 N2 O4 |
Smiles: | Cc1cc(cc(C)c1OCC(N1CCCC1)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.6249 |
logD: | 2.6249 |
logSw: | -2.6998 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 57.779 |
InChI Key: | GZTRLIQGWGMLJW-UHFFFAOYSA-N |