8FS
Summary
| Name: | 1-ethynyl-2,4-difluorobenzene |
| Formula: | C8 H4 F2 |
| Formal charge: | 0 |
| Formula weight: | 138.114 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-ethynyl-2,4-difluorobenzene |
| OpenEye OEToolkits | 2.0.6 | 1-ethynyl-2,4-bis(fluoranyl)benzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc1cc(F)ccc1C#C |
| InChI | InChI | 1.03 | InChI=1S/C8H4F2/c1-2-6-3-4-7(9)5-8(6)10/h1,3-5H |
| InChIKey | InChI | 1.03 | HRUJQXRGWQWYDH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(C#C)c(F)c1 |
| SMILES | CACTVS | 3.385 | Fc1ccc(C#C)c(F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C#Cc1ccc(cc1F)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | C#Cc1ccc(cc1F)F |
