3-(heptyloxy)-6-hydroxybenzene-1,2-dicarbonitrile
Chemical Structure Depiction of
3-(heptyloxy)-6-hydroxybenzene-1,2-dicarbonitrile
3-(heptyloxy)-6-hydroxybenzene-1,2-dicarbonitrile
Compound characteristics
Compound ID: | 0054-0059 |
Compound Name: | 3-(heptyloxy)-6-hydroxybenzene-1,2-dicarbonitrile |
Molecular Weight: | 258.32 |
Molecular Formula: | C15 H18 N2 O2 |
Smiles: | CCCCCCCOc1ccc(c(C#N)c1C#N)O |
Stereo: | ACHIRAL |
logP: | 4.5491 |
logD: | 2.4983 |
logSw: | -4.2973 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.403 |
InChI Key: | GGRHBZPQLRFEOU-UHFFFAOYSA-N |