Q4G
Summary
| Name: | 3-(3-fluorophenyl)benzoic acid |
| Formula: | C13 H9 F O2 |
| Formal charge: | 0 |
| Formula weight: | 216.208 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-(3-fluorophenyl)benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H9FO2/c14-12-6-2-4-10(8-12)9-3-1-5-11(7-9)13(15)16/h1-8H,(H,15,16) |
| InChIKey | InChI | 1.03 | MZZYPWIFSCZUHN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cccc(c1)c2cccc(F)c2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1cccc(c1)c2cccc(F)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)C(=O)O)c2cccc(c2)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)C(=O)O)c2cccc(c2)F |
