CFP
Summary
| Name: | 6-CHLORO-2-FLUOROPURINE |
| Formula: | C5 H2 Cl F N4 |
| Formal charge: | 0 |
| Formula weight: | 172.548 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 6-chloro-2-fluoro-9H-purine |
| OpenEye OEToolkits | 1.5.0 | 6-chloro-2-fluoro-9H-purine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Fc2nc1c(ncn1)c(Cl)n2 |
| SMILES_CANONICAL | CACTVS | 3.341 | Fc1nc(Cl)c2nc[nH]c2n1 |
| SMILES | CACTVS | 3.341 | Fc1nc(Cl)c2nc[nH]c2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)c(nc(n2)F)Cl |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)c(nc(n2)F)Cl |
| InChI | InChI | 1.03 | InChI=1S/C5H2ClFN4/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H,8,9,10,11) |
| InChIKey | InChI | 1.03 | UNRIYCIDCQDGQE-UHFFFAOYSA-N |
