4H-1-Benzopyran-2-carboxylic acid, 4-thioxo-, ethyl ester
ethyl 4-sulfanylidenechromene-2-carboxylate
Also Known As: ethyl 4-sulfanylidenechromene-2-carboxylate|ethyl 4-thioxo-4h-chromene-2-carboxylate|4H-1-Benzopyran-2-carboxylic acid, 4-thioxo-, ethyl ester|Ethyl 4-thioxo-4H-1-benzopyran-2-carboxylate|4-18-00-05567 (Beilstein Handbook Reference)|Ethyl 4-sulfanylidene-4H-1-benzopyran-2-carboxylate
CAS: 5410-63-9
| Molecular Formula | C12H10O3S |
|---|---|
| Molecular Weight | 234.03506 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 67.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.03506 |
| Monoisotopic Mass | 234.03506 |
| Heavy Atoms | 16 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 5410-63-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=S)C2=CC=CC=C2O1 |
| InChIKey | DXWBCHFGULQNLY-UHFFFAOYSA-N |
Product Overview
4H-1-Benzopyran-2-carboxylic acid, 4-thioxo-, ethyl ester (CAS 5410-63-9), with molecular formula C12H10O3S and molecular weight 234.03506 g/mol. IUPAC: ethyl 4-sulfanylidenechromene-2-carboxylate.
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.
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4H-1-Benzopyran-2-carboxylic acid, 4-thioxo-, ethyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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