methyl (1-methyl-3-nitro-1H-pyrazol-5-yl)acetate
Chemical Structure Depiction of
methyl (1-methyl-3-nitro-1H-pyrazol-5-yl)acetate
methyl (1-methyl-3-nitro-1H-pyrazol-5-yl)acetate
Compound characteristics
Compound ID: | Y507-3988 |
Compound Name: | methyl (1-methyl-3-nitro-1H-pyrazol-5-yl)acetate |
Molecular Weight: | 199.16 |
Molecular Formula: | C7 H9 N3 O4 |
Smiles: | Cn1c(CC(=O)OC)cc(n1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | -0.069 |
logD: | -0.069 |
logSw: | -0.8909 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 67.659 |
InChI Key: | PARABYXVZPIZKG-UHFFFAOYSA-N |