≥98 atom%,≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C 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.
| パブケム・シド | 488202201 |
|---|---|
| パブケム・シド・ウル | https://pubchem.ncbi.nlm.nih.gov/substance/488202201 |
| カノニカル・スマイル | C(=CC(=O)O)C(=O)O |
| IUPAC Name | (E)-(1,2,3,4-13C4)but-2-enedioic acid |
| InChIKey | VZCYOOQTPOCHFL-BHBLSLFXSA-N |
| INCHI | 1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+/i1+1,2+1,3+1,4+1 |
| 異性体SMILES | [13CH](=[13CH]/[13C](=O)O)\[13C](=O)O |
| 分子量 | 120.04 |
| Reaxy-Rn | 8132074 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8132074&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 |
| 分類 | Carboxylic acids and derivatives |
| Subclass | Dicarboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Dicarboxylic acids and derivatives |
| Alternative Parents | Unsaturated fatty acids Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acyl - Fatty acid - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| 説明 | This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups. |
| 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 |
|---|---|---|---|
 E2619032 | Certificate of Analysis | May 27, 2026 | F336547 |
| C2328524 | Certificate of Analysis | Jan 19, 2026 | F336547 |
| C2328619 | Certificate of Analysis | Jan 19, 2026 | F336547 |
| C2328651 | Certificate of Analysis | Jan 19, 2026 | F336547 |
| C2328709 | Certificate of Analysis | Jan 19, 2026 | F336547 |
| C2328808 | Certificate of Analysis | Jan 19, 2026 | F336547 |
| C2328527 | Certificate of Analysis | Jan 03, 2023 | F336547 |
| F2412058 | Certificate of Analysis | Jan 03, 2023 | F336547 |
| 溶解度 | DMSO (Slightly), Methanol (Sparingly, Sonicated) |
|---|---|
| 融点（°C） | >290° C |
| 分子量 | 120.043 g/mol |
| XLogP3 | -0.300 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 120.024 Da |
| Monoisotopic Mass | 120.024 Da |
| Topological Polar Surface Area | 74.600 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 119.000 |
| Isotope Atom Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 1 |
| Covalently-Bonded Unit Count | 1 |
