A1ABB
Summary
| Name: | (5P)-5-(furan-2-yl)thiophene-2-carboxylic acid |
| Formula: | C9 H6 O3 S |
| Formal charge: | 0 |
| Formula weight: | 194.207 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5P)-5-(furan-2-yl)thiophene-2-carboxylic acid |
| OpenEye OEToolkits | 2.0.7 | 5-(furan-2-yl)thiophene-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OC(=O)c1ccc(s1)c1occc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H6O3S/c10-9(11)8-4-3-7(13-8)6-2-1-5-12-6/h1-5H,(H,10,11) |
| InChIKey | InChI | 1.06 | ZASUJVQPFQRFPQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1sc(cc1)c2occc2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1sc(cc1)c2occc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)c2ccc(s2)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)c2ccc(s2)C(=O)O |
