A1JFU
Summary
| Name: | 2-[3,5-bis(fluoranyl)phenoxy]-2-methyl-propan-1-amine |
| Formula: | C10 H13 F2 N O |
| Formal charge: | 0 |
| Formula weight: | 201.213 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[3,5-bis(fluoranyl)phenoxy]-2-methyl-propan-1-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H13F2NO/c1-10(2,6-13)14-9-4-7(11)3-8(12)5-9/h3-5H,6,13H2,1-2H3 |
| InChIKey | InChI | 1.06 | JZJWBJNYSITKQL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(CN)Oc1cc(F)cc(F)c1 |
| SMILES | CACTVS | 3.385 | CC(C)(CN)Oc1cc(F)cc(F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(CN)Oc1cc(cc(c1)F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(CN)Oc1cc(cc(c1)F)F |
