![Methyl 3-nitro-5-[(2-oxothiolan-3-yl)carbamoyl]benzoate structure](/static/products/4481/448192-49-2.webp)
Methyl 3-nitro-5-[(2-oxothiolan-3-yl)carbamoyl]benzoate
methyl 3-nitro-5-[(2-oxothiolan-3-yl)carbamoyl]benzoate
Also Known As: CBMicro_012280|Oprea1_199141|Oprea1_843330|methyl 3-nitro-5-[(2-oxothiolan-3-yl)carbamoyl]benzoate|BAS 01937025|BIM-0012449.P001|AG-690/15431712|SR-01000435017-1|methyl 3-nitro-5-[(2-oxotetrahydrothiophen-3-yl)carbamoyl]benzoate|methyl 3-nitro-5-((2-oxotetrahydrothiophen-3-yl)carbamoyl)benzoate|5-Nitro-N-(2-oxo-tetrahydro-thiophen-3-yl)-isophthalamic acid methyl ester|methyl 3-nitro-5-[N-(2-oxo(3-3,4,5-trihydrothienyl))carbamoyl]benzoate|methyl 3-nitro-5-{[(2-oxotetrahydro-3-thienyl)amino]carbonyl}benzoate
| Molecular Formula | C13H12N2O6S |
|---|---|
| Molecular Weight | 324.0416 g/mol |
| LogP | 1.1433 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.0416 |
| Monoisotopic Mass | 324.0416 |
| Heavy Atoms | 22 |
| Complexity | 659.9304 |
Chemical Identifiers
| CAS Number | 448192-49-2 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)C(=O)NC2CCSC2=O)[N+](=O)[O-] |
Product Overview
Methyl 3-nitro-5-[(2-oxothiolan-3-yl)carbamoyl]benzoate (CAS 448192-49-2), with molecular formula C13H12N2O6S and molecular weight 324.0416 g/mol. IUPAC: methyl 3-nitro-5-[(2-oxothiolan-3-yl)carbamoyl]benzoate.