PBC
Summary
Name: | PHENYL BORONIC ACID |
Formula: | C6 H7 B O2 |
Formal charge: | 0 |
Formula weight: | 121.93 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | phenylboronic acid |
OpenEye OEToolkits | 1.5.0 | phenylboronic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OB(O)c1ccccc1 |
SMILES_CANONICAL | CACTVS | 3.341 | OB(O)c1ccccc1 |
SMILES | CACTVS | 3.341 | OB(O)c1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | B(c1ccccc1)(O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | B(c1ccccc1)(O)O |
InChI | InChI | 1.03 | InChI=1S/C6H7BO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H |
InChIKey | InChI | 1.03 | HXITXNWTGFUOAU-UHFFFAOYSA-N |