BDB
Summary
| Name: | 4,4'-BIPHENYLDIBORONIC ACID |
| Formula: | C12 H12 B2 O4 |
| Formal charge: | 0 |
| Formula weight: | 241.843 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | biphenyl-4,4'-diyldiboronic acid |
| OpenEye OEToolkits | 1.5.0 | [4-[4-(dihydroxyboranyl)phenyl]phenyl]boronic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OB(O)c1ccc(cc1)c2ccc(cc2)B(O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | OB(O)c1ccc(cc1)c2ccc(cc2)B(O)O |
| SMILES | CACTVS | 3.341 | OB(O)c1ccc(cc1)c2ccc(cc2)B(O)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | B(c1ccc(cc1)c2ccc(cc2)B(O)O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | B(c1ccc(cc1)c2ccc(cc2)B(O)O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C12H12B2O4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h1-8,15-18H |
| InChIKey | InChI | 1.03 | SLHKDOGTVUCXKX-UHFFFAOYSA-N |
