Determine the necessary mass, volume, or concentration for preparing a solution.
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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
|
E463138-1g
|
1g |
3
|
$69.90
|
|
|
E463138-5g
|
5g |
3
|
$241.90
|
|
|
E463138-25g
|
25g |
5
|
$893.90
|
|
| Synonyms | ETHYL 2-BROMO-4-CHLOROBENZOATE | 690260-90-3 | SCHEMBL5099711 | DTXSID30681765 | BUKXFSIXDJSOCF-UHFFFAOYSA-N | MFCD10566824 | ETHYL2-BROMO-4-CHLOROBENZOATE | AKOS015834909 | BS-24594 | CS-0138282 | E85300 |
|---|---|
| Specifications & Purity | ≥98% |
| Shipped In | Normal |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzoic acid esters |
| Alternative Parents | 4-halobenzoic acids and derivatives 2-halobenzoic acids and derivatives Benzoyl derivatives Chlorobenzenes Bromobenzenes Aryl chlorides Aryl bromides Vinylogous halides Carboxylic acid esters Organooxygen compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzoate ester - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - Chlorobenzene - Aryl bromide - Aryl chloride - Aryl halide - Vinylogous halide - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organic oxygen compound - Organochloride - Organooxygen compound - Organic oxide - Aromatic homomonocyclic compound |
| Description | 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 |
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| Pubchem Sid | 488201540 |
|---|---|
| IUPAC Name | ethyl 2-bromo-4-chlorobenzoate |
| INCHI | InChI=1S/C9H8BrClO2/c1-2-13-9(12)7-4-3-6(11)5-8(7)10/h3-5H,2H2,1H3 |
| InChIKey | BUKXFSIXDJSOCF-UHFFFAOYSA-N |
| Smiles | CCOC(=O)C1=C(C=C(C=C1)Cl)Br |
| Isomeric SMILES | CCOC(=O)C1=C(C=C(C=C1)Cl)Br |
| Molecular Weight | 263.52 |
| Reaxy-Rn | 14255029 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14255029&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 09, 2025 | E463138 | |
| Certificate of Analysis | May 09, 2025 | E463138 | |
| Certificate of Analysis | May 09, 2025 | E463138 | |
| Certificate of Analysis | Jun 14, 2022 | E463138 |
| Molecular Weight | 263.510 g/mol |
|---|---|
| XLogP3 | 3.800 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 261.94 Da |
| Monoisotopic Mass | 261.94 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 186.000 |
| 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 |