0D1
Summary
| Name: | 4,4'-(2,2-dichloroethene-1,1-diyl)diphenol |
| Formula: | C14 H10 Cl2 O2 |
| Formal charge: | 0 |
| Formula weight: | 281.134 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4,4'-(2,2-dichloroethene-1,1-diyl)diphenol |
| OpenEye OEToolkits | 1.7.6 | 4-[2,2-bis(chloranyl)-1-(4-hydroxyphenyl)ethenyl]phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cl/C(Cl)=C(/c1ccc(O)cc1)c2ccc(O)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H10Cl2O2/c15-14(16)13(9-1-5-11(17)6-2-9)10-3-7-12(18)8-4-10/h1-8,17-18H |
| InChIKey | InChI | 1.03 | OWEYKIWAZBBXJK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccc(cc1)C(=C(Cl)Cl)c2ccc(O)cc2 |
| SMILES | CACTVS | 3.370 | Oc1ccc(cc1)C(=C(Cl)Cl)c2ccc(O)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1C(=C(Cl)Cl)c2ccc(cc2)O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1C(=C(Cl)Cl)c2ccc(cc2)O)O |
