4-Carboxy-2,3,5,6-tetrafluorobenzeneacetic acid
4-(carboxymethyl)-2,3,5,6-tetrafluorobenzoic acid
Also Known As: tetrafluorohomoterephthalic acid|Oprea1_138319|Oprea1_409233|4-Carboxy-2,3,5,6-tetrafluorobenzeneacetic acid|4-(carboxymethyl)-2,3,5,6-tetrafluorobenzoic acid|AG-690/11959223|4-(carboxymethyl)-2,3,5,6-tetrafluoro-benzoic Acid
CAS: 3516-90-3
| Molecular Formula | C9H4F4O4 |
|---|---|
| Molecular Weight | 252.00458 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.00458 |
| Monoisotopic Mass | 252.00458 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 3516-90-3 |
|---|---|
| SMILES | C(C1=C(C(=C(C(=C1F)F)C(=O)O)F)F)C(=O)O |
| InChIKey | NYOXYRPDRWRVTQ-UHFFFAOYSA-N |
Product Overview
4-Carboxy-2,3,5,6-tetrafluorobenzeneacetic acid (CAS 3516-90-3), with molecular formula C9H4F4O4 and molecular weight 252.00458 g/mol. IUPAC: 4-(carboxymethyl)-2,3,5,6-tetrafluorobenzoic 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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