DUG
Summary
| Name: | (3-chloro-4-fluorophenoxy)acetaldehyde |
| Formula: | C8 H6 Cl F O2 |
| Formal charge: | 0 |
| Formula weight: | 188.583 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3-chloro-4-fluorophenoxy)acetaldehyde |
| OpenEye OEToolkits | 2.0.6 | 2-(3-chloranyl-4-fluoranyl-phenoxy)ethanal |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc1ccc(cc1Cl)OCC=O |
| InChI | InChI | 1.03 | InChI=1S/C8H6ClFO2/c9-7-5-6(12-4-3-11)1-2-8(7)10/h1-3,5H,4H2 |
| InChIKey | InChI | 1.03 | WUZVUZGMLKOYAH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(OCC=O)cc1Cl |
| SMILES | CACTVS | 3.385 | Fc1ccc(OCC=O)cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1OCC=O)Cl)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1OCC=O)Cl)F |
