4CH
Summary
Name: | 4-chlorophenol |
Formula: | C6 H5 Cl O |
Formal charge: | 0 |
Formula weight: | 128.556 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 4-chlorophenol |
OpenEye OEToolkits | 1.5.0 | 4-chlorophenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc1ccc(O)cc1 |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(Cl)cc1 |
SMILES | CACTVS | 3.341 | Oc1ccc(Cl)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1O)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1O)Cl |
InChI | InChI | 1.03 | InChI=1S/C6H5ClO/c7-5-1-3-6(8)4-2-5/h1-4,8H |
InChIKey | InChI | 1.03 | WXNZTHHGJRFXKQ-UHFFFAOYSA-N |