V7M
Summary
| Name: | 1-fluoro-3,5-dimethylbenzene |
| Formula: | C8 H9 F |
| Formal charge: | 0 |
| Formula weight: | 124.155 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-fluoro-3,5-dimethylbenzene |
| OpenEye OEToolkits | 2.0.7 | 1-fluoranyl-3,5-dimethyl-benzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1cc(cc(c1)C)F |
| InChI | InChI | 1.03 | InChI=1S/C8H9F/c1-6-3-7(2)5-8(9)4-6/h3-5H,1-2H3 |
| InChIKey | InChI | 1.03 | RCWIWNUVHNAUQC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(C)cc(F)c1 |
| SMILES | CACTVS | 3.385 | Cc1cc(C)cc(F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(cc(c1)F)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(cc(c1)F)C |
