YUG
Summary
| Name: | 2,6-dibromo-3-(2,4-dibromophenoxy)phenol |
| Formula: | C12 H6 Br4 O2 |
| Formal charge: | 0 |
| Formula weight: | 501.791 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2,6-dibromo-3-(2,4-dibromophenoxy)phenol |
| OpenEye OEToolkits | 1.7.6 | 3-[2,4-bis(bromanyl)phenoxy]-2,6-bis(bromanyl)phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Brc2ccc(Oc1ccc(Br)cc1Br)c(Br)c2O |
| InChI | InChI | 1.03 | InChI=1S/C12H6Br4O2/c13-6-1-3-9(8(15)5-6)18-10-4-2-7(14)12(17)11(10)16/h1-5,17H |
| InChIKey | InChI | 1.03 | JKSJZAPNQVINPS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1c(Br)ccc(Oc2ccc(Br)cc2Br)c1Br |
| SMILES | CACTVS | 3.370 | Oc1c(Br)ccc(Oc2ccc(Br)cc2Br)c1Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1Br)Br)Oc2ccc(c(c2Br)O)Br |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(cc1Br)Br)Oc2ccc(c(c2Br)O)Br |
