SJU
Summary
| Name: | (furan-2-yl)acetic acid |
| Formula: | C6 H6 O3 |
| Formal charge: | 0 |
| Formula weight: | 126.11 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (furan-2-yl)acetic acid |
| OpenEye OEToolkits | 2.0.7 | 2-(furan-2-yl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)Cc1ccco1 |
| InChI | InChI | 1.06 | InChI=1S/C6H6O3/c7-6(8)4-5-2-1-3-9-5/h1-3H,4H2,(H,7,8) |
| InChIKey | InChI | 1.06 | VYSRZETUSAOIMP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)Cc1occc1 |
| SMILES | CACTVS | 3.385 | OC(=O)Cc1occc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)CC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)CC(=O)O |
