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| Synonyms | 1-phenyl-2-bromoethanone | 2-bromo-1-phenyl-1-ethanone | Benzoylmethyl bromide | NCGC00260487-01 | NSC 9807 | UN2645 | UN-2645 | EINECS 200-724-9 | phenacylbromid | .OMEGA.-BROMOACETOPHENONE [MI] | AKOS000210403 | 2-bromo-1 -phenylethanone | CHEBI:51846 | |
|---|---|
| Specifications & Purity | ≥98% |
| Storage Temp | Store at 2-8°C,Protected from light,Argon charged |
| Shipped In |
Wet ice This product requires cold chain shipping. Ground and other economy services are not available. |
| Product Description |
2-Bromoacetophenone has been used in the analysis of organic acids involving the formation of phenacyl derivatives. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Ketones - Aryl ketones - Phenylketones |
| Direct Parent | Alkyl-phenylketones |
| Alternative Parents | Benzoyl derivatives Aryl alkyl ketones Alpha-haloketones Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Alkyl-phenylketone - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Alpha-haloketone - Organic oxide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. |
| External Descriptors | alpha-bromoketone - aromatic ketone - acetophenones |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| Pubchem Sid | 488180031 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180031 |
| IUPAC Name | 2-bromo-1-phenylethanone |
| INCHI | InChI=1S/C8H7BrO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | LIGACIXOYTUXAW-UHFFFAOYSA-N |
| Smiles | C1=CC=C(C=C1)C(=O)CBr |
| Isomeric SMILES | C1=CC=C(C=C1)C(=O)CBr |
| WGK Germany | 3 |
| UN Number | 2645 |
| Packing Group | II |
| Molecular Weight | 199.04 |
| Beilstein | 606474 |
| Reaxy-Rn | 606474 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606474&ln= |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | May 15, 2025 | B103328 | |
| Certificate of Analysis | Feb 07, 2025 | B103328 | |
| Certificate of Analysis | Feb 07, 2025 | B103328 | |
| Certificate of Analysis | Feb 07, 2025 | B103328 | |
| Certificate of Analysis | Feb 07, 2025 | B103328 | |
| Certificate of Analysis | Feb 07, 2025 | B103328 | |
| Certificate of Analysis | Feb 07, 2025 | B103328 | |
| Certificate of Analysis | Oct 11, 2024 | B103328 | |
| Certificate of Analysis | Oct 11, 2024 | B103328 | |
| Certificate of Analysis | Oct 11, 2024 | B103328 | |
| Certificate of Analysis | Oct 11, 2024 | B103328 | |
| Certificate of Analysis | Apr 01, 2024 | B103328 | |
| Certificate of Analysis | Apr 01, 2024 | B103328 | |
| Certificate of Analysis | Aug 17, 2023 | B103328 | |
| Certificate of Analysis | Aug 17, 2023 | B103328 | |
| Certificate of Analysis | May 09, 2023 | B103328 | |
| Certificate of Analysis | May 09, 2023 | B103328 | |
| Certificate of Analysis | Jul 21, 2022 | B103328 | |
| Certificate of Analysis | Jul 21, 2022 | B103328 | |
| Certificate of Analysis | Jul 21, 2022 | B103328 | |
| Certificate of Analysis | Jul 21, 2022 | B103328 |
| Solubility | Solubility in Methanol:almost transparency |
|---|---|
| Sensitivity | Light & Heat & Air sensitive. |
| Refractive Index | 1.709 |
| Flash Point(°F) | 235.4 °F |
| Flash Point(°C) | 113 °C |
| Boil Point(°C) | 135 °C/18 mmHg |
| Melt Point(°C) | 51°C |
| Molecular Weight | 199.040 g/mol |
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 197.968 Da |
| Monoisotopic Mass | 197.968 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 116.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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