HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 796366Generated: October 27, 2026
Benzenesulfonamide, N-[(4-methoxyphenyl)methyl]-2-nitro-
https://huagongshe.com/en/chemical/796366
Identifiers & Physical Properties
| CAS No. | 171414-16-7 |
|---|
| Molecular formula | C14H14N2O5S |
|---|
| Average molar mass | 322.34 g/mol |
|---|
| Monoisotopic mass | 322.06234255 g/mol |
|---|
| SMILES | COc1ccc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 |
|---|
| InChIKey | XJLAYQTXRMHPQR-UHFFFAOYSA-N |
|---|
| PubChem CID | 796366 |
|---|
| DTXSID | DTXSID50355310 |
|---|
Chemical & Physical Properties
| XLogP | 2.2 |
|---|
| Topological polar surface area | 110 |
|---|
| Hydrogen bond donors | 1 |
|---|
| Hydrogen bond acceptors | 6 |
|---|
| Rotatable bonds | 5 |
|---|
| Heavy atoms | 22 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 463 |
|---|