8IB
Summary
| Name: | 2-Hydroxyterephthalic acid |
| Synonyms: | 2-oxidanylterephthalic acid 2-hydroxybenzene-1,4-dicarboxylic acid; 2-hydroxyterephthalate |
| Formula: | C8 H6 O5 |
| Formal charge: | 0 |
| Formula weight: | 182.13 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-oxidanylterephthalic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H6O5/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3,9H,(H,10,11)(H,12,13) |
| InChIKey | InChI | 1.06 | CDOWNLMZVKJRSC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccc(C(O)=O)c(O)c1 |
| SMILES | CACTVS | 3.385 | OC(=O)c1ccc(C(O)=O)c(O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1C(=O)O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1C(=O)O)O)C(=O)O |
