Benzoic acid, 2-(1-oxo-1H-2-benzopyran-3-yl)-
2-(1-oxoisochromen-3-yl)benzoic acid
Also Known As: 2-(1-Oxo-1H-isochromen-3-yl)benzoic acid|3-(2-carboxyphenyl)isocoumarin|2-(1-oxoisochromen-3-yl)benzoic Acid|Benzoic acid, 2-(1-oxo-1H-2-benzopyran-3-yl)-|2-(1-Oxo-1H-2-benzopyran-3-yl)benzoic acid|J2.174.440I
CAS: 792-23-4
| Molecular Formula | C16H10O4 |
|---|---|
| Molecular Weight | 266.05792 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.05792 |
| Monoisotopic Mass | 266.05792 |
| Heavy Atoms | 20 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 792-23-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(OC2=O)C3=CC=CC=C3C(=O)O |
| InChIKey | XVWRERRMNCYVHV-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-(1-oxo-1H-2-benzopyran-3-yl)- (CAS 792-23-4), with molecular formula C16H10O4 and molecular weight 266.05792 g/mol. IUPAC: 2-(1-oxoisochromen-3-yl)benzoic acid.
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 →
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