![Methyl 4-{[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanyl}benzoate structure](/static/products/6985/69856-33-3.webp)
Methyl 4-{[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanyl}benzoate
methyl 4-[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanylbenzoate
Also Known As: methyl 4-[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanylbenzoate|Methyl 4-{[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanyl}benzoate|Methyl 4-{[2-(5-nitro-2-furyl)-2-oxoethyl]thio}benzoate|methyl 4-[2-(5-nitro-2-furyl)-2-oxo-ethyl]sulfanylbenzoate
CAS: 69856-33-3
| Molecular Formula | C14H11NO6S |
|---|---|
| Molecular Weight | 321.0307 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.0307 |
| Monoisotopic Mass | 321.0307 |
| Heavy Atoms | 22 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 69856-33-3 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)SCC(=O)C2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | USXBCDYQHNTZKF-UHFFFAOYSA-N |
Product Overview
Methyl 4-{[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanyl}benzoate (CAS 69856-33-3), with molecular formula C14H11NO6S and molecular weight 321.0307 g/mol. IUPAC: methyl 4-[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanylbenzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
Methyl 4-{[2-(5-nitrofuran-2-yl)-2-oxoethyl]sulfanyl}benzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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