7FN
Summary
| Name: | 2,5 Furan Dicarboxylic Acid |
| Formula: | C6 H4 O5 |
| Formal charge: | 0 |
| Formula weight: | 156.093 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | furan-2,5-dicarboxylic acid |
| OpenEye OEToolkits | 2.0.6 | furan-2,5-dicarboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OC(=O)c1ccc(o1)C(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C6H4O5/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)(H,9,10) |
| InChIKey | InChI | 1.03 | CHTHALBTIRVDBM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1oc(cc1)C(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)c1oc(cc1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(oc1C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(oc1C(=O)O)C(=O)O |
