4,4'-(Hexane-1,6-diylbis(oxy))bis(3-bromobenzonitrile) (CHEM073578)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-04 10:17:38 UTC | ||||||||
| Update Date | 2026-04-04 10:17:38 UTC | ||||||||
| Accession Number | CHEM073578 | ||||||||
| Identification | |||||||||
| Common Name | 4,4'-(Hexane-1,6-diylbis(oxy))bis(3-bromobenzonitrile) | ||||||||
| Class | Small Molecule | ||||||||
| Description | 4,4'-(Hexane-1,6-diylbis(oxy))bis(3-bromobenzonitrile) belongs to the phenol ethers, a class of benzenoids within the organic compounds. This compound has the chemical formula C20H18Br2N2O2 and an average molecular weight of 478.18 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C20H18Br2N2O2 | ||||||||
| Average Molecular Mass | 478.184 g/mol | ||||||||
| Monoisotopic Mass | 475.974 g/mol | ||||||||
| CAS Registry Number | 65693-92-7 | ||||||||
| IUPAC Name | 3-bromo-4-[6-(2-bromo-4-cyanophenoxy)hexoxy]benzonitrile | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | BrC1=C(OCCCCCCOC2=C(Br)C=C(C=C2)C#N)C=CC(=C1)C#N | ||||||||
| InChI Identifier | InChI=1S/C20H18Br2N2O2/c21-17-11-15(13-23)5-7-19(17)25-9-3-1-2-4-10-26-20-8-6-16(14-24)12-18(20)22/h5-8,11-12H,1-4,9-10H2 | ||||||||
| InChI Key | VDHFAPUSOGNRCA-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
