A1ABE
(3M)-3-(furan-2-yl)benzoic acid
Find entries where: A1ABE
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | (3M)-3-(furan-2-yl)benzoic acid |
| Identifiers | 3-(furan-2-yl)benzoic acid |
| Formula | C11 H8 O3 |
| Molecular Weight | 188.179 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(cc(c1)C(=O)O)c2ccco2 |
| InChI | InChI=1S/C11H8O3/c12-11(13)9-4-1-3-8(7-9)10-5-2-6-14-10/h1-7H,(H,12,13) |
| InChIKey | RQVVFGRDMHDHNI-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 22 |
| Chiral Atom Count | 0 |
| Bond Count | 23 |
| Aromatic Bond Count | 11 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 5037933 |
| ChEMBL | CHEMBL5219161 |
| CCDC/CSD | EPAHAF |
| COD | 1519824 |
