Y1H
Summary
| Name: | (6-fluoro-2H,4H-1,3-benzodioxin-8-yl)methanol |
| Formula: | C9 H9 F O3 |
| Formal charge: | 0 |
| Formula weight: | 184.164 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (6-fluoro-2H,4H-1,3-benzodioxin-8-yl)methanol |
| OpenEye OEToolkits | 2.0.7 | (6-fluoranyl-4~{H}-1,3-benzodioxin-8-yl)methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc1cc2COCOc2c(c1)CO |
| InChI | InChI | 1.06 | InChI=1S/C9H9FO3/c10-8-1-6(3-11)9-7(2-8)4-12-5-13-9/h1-2,11H,3-5H2 |
| InChIKey | InChI | 1.06 | YLADDVZIEBXWQU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCc1cc(F)cc2COCOc12 |
| SMILES | CACTVS | 3.385 | OCc1cc(F)cc2COCOc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(cc(c2c1COCO2)CO)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(cc(c2c1COCO2)CO)F |
