LJ4
Summary
| Name: | 2,6-dibromo-4-phenoxyphenol |
| Synonyms: | 1,3-Dibromo-2-hydroxy-5-phenoxybenzene |
| Formula: | C12 H8 Br2 O2 |
| Formal charge: | 0 |
| Formula weight: | 343.999 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,6-dibromo-4-phenoxyphenol |
| OpenEye OEToolkits | 1.5.0 | 2,6-dibromo-4-phenoxy-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Brc2cc(Oc1ccccc1)cc(Br)c2O |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1c(Br)cc(Oc2ccccc2)cc1Br |
| SMILES | CACTVS | 3.341 | Oc1c(Br)cc(Oc2ccccc2)cc1Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)Oc2cc(c(c(c2)Br)O)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)Oc2cc(c(c(c2)Br)O)Br |
| InChI | InChI | 1.03 | InChI=1S/C12H8Br2O2/c13-10-6-9(7-11(14)12(10)15)16-8-4-2-1-3-5-8/h1-7,15H |
| InChIKey | InChI | 1.03 | CRSZEDOZGJPOHP-UHFFFAOYSA-N |
