≥95% 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 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Didecyl phthalate has been used as stationary liquid phase in the analysis and separation of terpene hydrocarbons and other related compounds using gas chromatography method (GC).
Didecyl phthalate may be used as an analytical reference standard for the quantification of the analyte in environmental samples, plastics and agricultural plastic filmsusing various chromatography techniques.
| Sonrisas canónicas | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC |
|---|---|
| IUPAC Name | didecyl benzene-1,2-dicarboxylate |
| InChIKey | PGIBJVOPLXHHGS-UHFFFAOYSA-N |
| INCHI | 1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3 |
| Isómeros SMILES | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC |
| WGK Alemania | 1 |
| RTECS | TI0900000 |
| Peso molecular | 446.66 |
| Beilstein | 1893077 |
| Reaxy-Rn | 1893077 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1893077&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 |
| Clase | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzoic acid esters |
| Alternative Parents | Benzoyl derivatives Dicarboxylic acids and derivatives Carboxylic acid esters Organooxygen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzoate ester - Benzoyl - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. |
| External Descriptors | 2-hydroxyisophthalic acid |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 F23061502 | Certificate of Analysis | Jul 26, 2022 | D104486 |
| I2207176 | Certificate of Analysis | Jul 26, 2022 | D104486 |
| I2209174 | Certificate of Analysis | Jul 26, 2022 | D104486 |
| I2209175 | Certificate of Analysis | Jul 26, 2022 | D104486 |
| I2414084 | Certificate of Analysis | Jul 26, 2022 | D104486 |
| B2223107 | Certificate of Analysis | Feb 28, 2022 | D104486 |
| Índice de refracción | 1.479-1.484 |
|---|---|
| Punto de inflamación (°F) | 232℃ |
| Punto de inflamación (°C) | 232℃ |
| Punto de ebullición (°C) | 261°C |
| Punto de fusión (°C) | 4°C |
| Peso molecular | 446.700 g/mol |
| XLogP3 | 11.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 22 |
| Exact Mass | 446.34 Da |
| Monoisotopic Mass | 446.34 Da |
| Topological Polar Surface Area | 52.600 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 420.000 |
| 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 |
| 1. Leng Yue, Sun Yonghai, Huang Wei, Lv Chengyu, Cui Jingyan, Li Tiezhu, Wang Yongjun. (2021) Identification of dicyclohexyl phthalate as a glucocorticoid receptor antagonist by molecular docking and multiple in vitro methods. MOLECULAR BIOLOGY REPORTS, 48 (4): (3145-3154). [PMID:33881729] [10.1007/s11033-021-06303-2] |
| 2. Yi Hao, Yuan Gao, Luyao Gao, Yulian He, Yingying Niu, Sameer Hussain, Ruixia Gao, Lisa D. Pfefferle, M. Shahid, Sicen Wang. (2021) Amphiphilic core–shell magnetic adsorbents for efficient removal and detection of phthalate esters. CHEMICAL ENGINEERING JOURNAL, [PMID:] [10.1016/j.cej.2021.129817] |
| 3. Luyao Gao, Yuhai Tang, Chaofeng Wang, Lu Yao, Junjie Zhang, Ruixia Gao, Xiaoshuang Tang, Tie Chong, Huan Zhang. (2019) Highly-efficient amphiphilic magnetic nanocomposites based on a simple sol-gel modification for adsorption of phthalate esters. JOURNAL OF COLLOID AND INTERFACE SCIENCE, [PMID:31121431] [10.1016/j.jcis.2019.05.031] |
| 4. Jianjun Shu, Pengfei Xie, Danni Lin, Rongfeng Chen, Jiang Wang, Beibei Zhang, Mingming Liu, Hanlan Liu, Fan Liu. (2013) Two highly stable and selective solid phase microextraction fibers coated with crown ether functionalized ionic liquids by different sol–gel reaction approaches. ANALYTICA CHIMICA ACTA, [PMID:24331051] [10.1016/j.aca.2013.11.006] |
