3-Oxo-1,3-dihydro-2-benzofuran-1-carboxylic acid
3-oxo-1H-2-benzofuran-1-carboxylic acid
Also Known As: 3-oxo-1,3-dihydro-2-benzofuran-1-carboxylic acid|phthalidecarboxylic acid|3-Phthalidecarboxylic acid|phthalide-3-carboxylic acid|3-oxo-1H-2-benzofuran-1-carboxylic acid|TPL0123|3-oxohydroisobenzofurancarboxylic acid|3-oxo-1H-isobenzofuran-1-carboxylic acid|3(1H)-Oxoisobenzofuran-1-carboxylic acid|3-Oxo-1,3-dihydroisobenzofuran-1-carboxylic acid|1-Isobenzofurancarboxylic acid, 1,3-dihydro-3-oxo-|1,3-dihydro-3-oxo-1-isobenzofurancarboxylic acid|3-oxo-1,3-dihydro-1-isobenzofurancarboxylic acid|3-oxo-1,3-dihydro-2-benzofuran-1-carboxylicacid|AO-801/41077494|836-923-8
| Molecular Formula | C9H6O4 |
|---|---|
| Molecular Weight | 178.02661 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.02661 |
| Monoisotopic Mass | 178.02661 |
| Heavy Atoms | 13 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 708-14-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(OC2=O)C(=O)O |
| InChIKey | FRHBUJIXNLOLOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Oxo-1,3-dihydro-2-benzofuran-1-carboxylic acid (CAS 708-14-5), with molecular formula C9H6O4 and molecular weight 178.02661 g/mol. IUPAC: 3-oxo-1H-2-benzofuran-1-carboxylic acid.
3-Oxo-1,3-dihydro-2-benzofuran-1-carboxylic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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