4-(2-Bromoethyl)benzoic acid (CHEM070992)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-04 02:53:18 UTC | ||||||||
| Update Date | 2026-08-25 22:37:18 UTC | ||||||||
| Accession Number | CHEM070992 | ||||||||
| Identification | |||||||||
| Common Name | 4-(2-Bromoethyl)benzoic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 4-(2-Bromoethyl)benzoic acid belongs to the benzoic acids and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C9H9Br1O2 and an average molecular weight of 229.07 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C9H9Br1O2 | ||||||||
| Average Molecular Mass | 229.073 g/mol | ||||||||
| Monoisotopic Mass | 227.979 g/mol | ||||||||
| CAS Registry Number | 52062-92-7 | ||||||||
| IUPAC Name | 4-(2-bromoethyl)benzoic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | OC(=O)C1=CC=C(CCBr)C=C1 | ||||||||
| InChI Identifier | InChI=1S/C9H9BrO2/c10-6-5-7-1-3-8(4-2-7)9(11)12/h1-4H,5-6H2,(H,11,12) | ||||||||
| InChI Key | BKMRWJWLBHHGCF-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 | ||||||||
| Spectra | |||||||||
| Spectra |
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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 | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
