≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Ethyl 2-bromobenzoate is an halobenzoic acid ethyl ester. Silylation and hydrolysis of ethyl 2-bromobenzoate has been reported.
| パブケム・シド | 488185825 |
|---|---|
| パブケム・シド・ウル | https://pubchem.ncbi.nlm.nih.gov/substance/488185825 |
| カノニカル・スマイル | CCOC(=O)C1=CC=CC=C1Br |
| IUPAC Name | ethyl 2-bromobenzoate |
| InChIKey | BIHHBTVQFPVSTE-UHFFFAOYSA-N |
| INCHI | 1S/C9H9BrO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3 |
| 異性体SMILES | CCOC(=O)C1=CC=CC=C1Br |
| WGKドイツ | 3 |
| 分子量 | 229.07 |
| Beilstein | 9(4)1012 |
| Reaxy-Rn | 2207360 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2207360&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| 分類 | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzoic acid esters |
| Alternative Parents | 2-halobenzoic acids and derivatives Benzoyl derivatives Bromobenzenes Aryl bromides Vinylogous halides Carboxylic acid esters Monocarboxylic acids and derivatives Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzoate ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Vinylogous halide - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Aromatic homomonocyclic compound |
| 説明 | This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 日付 | 商品 |
|---|---|---|---|
 G1714043 | Certificate of Analysis | Feb 07, 2025 | E156198 |
| I2320694 | Certificate of Analysis | Mar 04, 2023 | E156198 |
| I2320699 | Certificate of Analysis | Mar 04, 2023 | E156198 |
| I2320700 | Certificate of Analysis | Mar 04, 2023 | E156198 |
| I2320701 | Certificate of Analysis | Mar 04, 2023 | E156198 |
| I2320702 | Certificate of Analysis | Mar 04, 2023 | E156198 |
| G2304720 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304721 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304722 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304723 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304813 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304818 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304819 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304847 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304859 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| G2304882 | Certificate of Analysis | Jan 16, 2023 | E156198 |
| 屈折率 | 1.544 |
|---|---|
| 引火点（°F） | 230°F |
| 引火点（°C） | >110°C |
| 沸点（°C） | 117°C/17 mmHg |
| 分子量 | 229.070 g/mol |
| XLogP3 | 3.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 227.979 Da |
| Monoisotopic Mass | 227.979 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 159.000 |
| 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 |
