1-butoxy-1-oxopropan-2-yl 3-methyl-4-nitrobenzoate
Chemical Structure Depiction of
1-butoxy-1-oxopropan-2-yl 3-methyl-4-nitrobenzoate
1-butoxy-1-oxopropan-2-yl 3-methyl-4-nitrobenzoate
Compound characteristics
| Compound ID: | 0526-5774 |
| Compound Name: | 1-butoxy-1-oxopropan-2-yl 3-methyl-4-nitrobenzoate |
| Molecular Weight: | 309.32 |
| Molecular Formula: | C15 H19 N O6 |
| Smiles: | CCCCOC(C(C)OC(c1ccc(c(C)c1)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6789 |
| logD: | 3.6789 |
| logSw: | -3.9094 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.786 |
| InChI Key: | GSOYXPORMCAKFU-NSHDSACASA-N |