Ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate
ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate
Also Known As: 2-ethoxycarbonyl-5-cyanomethylbenzofuran|ethyl 5-(cyanomethyl)benzofuran-2-carboxylate|ethyl 5-cyanomethylbenzofuran-2-carboxylate|ethyl 5-cyanomethylbenzo[b]furan-2-carboxylate|Ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate|Ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate #|Benzofuran-2-carboxylic acid, 5-cyanomethyl-, ethyl ester
| Molecular Formula | C13H11NO3 |
|---|---|
| Molecular Weight | 229.0739 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.0739 |
| Monoisotopic Mass | 229.0739 |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 37797-91-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(O1)C=CC(=C2)CC#N |
| InChIKey | XEQYWHNMYTXFJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate (CAS 37797-91-4), with molecular formula C13H11NO3 and molecular weight 229.0739 g/mol. IUPAC: ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate.
Ethyl 5-(cyanomethyl)-1-benzofuran-2-carboxylate is a custom synthesis product. We offer services from milligram to kilogram scale.
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