A1CF8
Summary
| Name: | Tavaborole |
| Synonyms: | 5-fluoro-2,1-benzoxaborol-1(3H)-ol |
| Formula: | C7 H6 B F O2 |
| Formal charge: | 0 |
| Formula weight: | 151.931 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 5-fluoro-2,1-benzoxaborol-1(3H)-ol |
| OpenEye OEToolkits | 3.1.0.0 | 5-fluoranyl-1-oxidanyl-3~{H}-2,1-benzoxaborole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | OB1OCc2cc(F)ccc12 |
| InChI | InChI | 1.06 | InChI=1S/C7H6BFO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,10H,4H2 |
| InChIKey | InChI | 1.06 | LFQDNHWZDQTITF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OB1OCc2cc(F)ccc12 |
| SMILES | CACTVS | 3.385 | OB1OCc2cc(F)ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | B1(c2ccc(cc2CO1)F)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | B1(c2ccc(cc2CO1)F)O |
