≥93% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Argon charged Ships Wet ice 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.
| Pubchem Sid | 508814204 |
|---|---|
| Sorrisi canonici | CCOC(=O)C(C(=O)C(=O)OCC)Cl |
| IUPAC Name | diethyl 2-chloro-3-oxobutanedioate |
| InChIKey | JNQWFLVFHCCWPV-UHFFFAOYSA-N |
| INCHI | 1S/C8H11ClO5/c1-3-13-7(11)5(9)6(10)8(12)14-4-2/h5H,3-4H2,1-2H3 |
| Isomeri SMILES | CCOC(=O)C(C(=O)C(=O)OCC)Cl |
| Peso molecolare | 222.62 |
| Beilstein | 3(4)1811 |
| Reaxy-Rn | 610231 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=610231&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 | Organic acids and derivatives |
| Classe | Keto acids and derivatives |
| Subclass | Beta-keto acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Beta-keto acids and derivatives |
| Alternative Parents | Fatty acid esters Dicarboxylic acids and derivatives Alpha-keto acids and derivatives 1,3-dicarbonyl compounds Alpha-halocarboxylic acid derivatives Alpha-chloroketones Carboxylic acid esters Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Beta-keto acid - Fatty acid ester - Alpha-keto acid - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Fatty acyl - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Alpha-haloketone - Alpha-chloroketone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Alkyl chloride - Organic oxygen compound - Carbonyl group - Organochloride - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Aliphatic acyclic compound |
| Descrizione | This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Data | Oggetto |
|---|---|---|---|
 F2414232 | Certificate of Analysis | Nov 30, 2023 | D123545 |
| F2414234 | Certificate of Analysis | Nov 30, 2023 | D123545 |
| F2414235 | Certificate of Analysis | Nov 30, 2023 | D123545 |
| F2414237 | Certificate of Analysis | Nov 30, 2023 | D123545 |
| F2414324 | Certificate of Analysis | Nov 30, 2023 | D123545 |
| F2414348 | Certificate of Analysis | Nov 30, 2023 | D123545 |
| Sensibilità | heat sensitive,Moisture sensitive |
|---|---|
| Indice di rifrazione | 1.45 |
| Punto di infiammabilità (°C) | 108 °C |
| Punto di ebollizione (°C) | 130°C/9mmHg |
| Peso molecolare | 222.620 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 222.03 Da |
| Monoisotopic Mass | 222.03 Da |
| Topological Polar Surface Area | 69.700 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 238.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
