WKK
Summary
| Name: | 1-benzothiophen-3-ylboronic acid |
| Formula: | C8 H7 B O2 S |
| Formal charge: | 0 |
| Formula weight: | 178.016 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-benzothiophen-3-ylboronic acid |
| OpenEye OEToolkits | 2.0.7 | 1-benzothiophen-3-ylboronic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | OB(O)c1csc2ccccc21 |
| InChI | InChI | 1.06 | InChI=1S/C8H7BO2S/c10-9(11)7-5-12-8-4-2-1-3-6(7)8/h1-5,10-11H |
| InChIKey | InChI | 1.06 | QVANIYYVZZLQJP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OB(O)c1csc2ccccc12 |
| SMILES | CACTVS | 3.385 | OB(O)c1csc2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | B(c1csc2c1cccc2)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | B(c1csc2c1cccc2)(O)O |
