Diethylhexyl phthalate

Di(2-ethylhexyl) phthalate

CAS 117-81-7  ·  C24H38O4  ·  MW 390.6 g/mol

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3D model Di(2-ethylhexyl) phthalate, CAS 117-81-7, molecular formula C24H38O4, molar mass 390.6 g/mol
About Diethylhexyl phthalate

Diethylhexyl phthalate is a chemical compound registered under number CAS 117-81-7, with the molecular formula C24H38O4, and a molar mass of 390.6 g/mol.

The molecule contains 66 atoms connected by 66 chemical bonds. The full systematic IUPAC name of this compound is bis(2-ethylhexyl) benzene-1,2-dicarboxylate. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 7.4 (positive value, a lipophilic compound), polar surface area PSA = 52.6 Ų, 0 donors and 4 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Wzór sumarycznyC24H38O4
Masa molowa390.6 g/mol
IUPACbis(2-ethylhexyl) benzene-1,2-dicarboxylate
SMILESCCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC
InChIKeyBJQHLKABXJIVAM-UHFFFAOYSA-N
logP (XLogP3)7.4
PSA52.6 Ų
HBD / HBA0 / 4
PubChem CIDCID 8343 ↗
GHS safety

Sygnał: Niebezpieczeństwo

GHS08
GHS08

? — H360FD

Scientific literature

Related literature

20 artykułów · 10 open access · Źródła: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Timeline publikacji (20 artykułów)

1982: 2 artykułów19822001: 1 artykułów2006: 1 artykułów2009: 1 artykułów2014: 1 artykułów20142020: 1 artykułów2022: 1 artykułów2025: 2 artykułów2026: 10 artykułów2026

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Lesa L. Aylward, Sean M. Hays, Michelle Gagné et al. (2009) · Regulatory Toxicology and Pharmacology
AI Summary
This study reviews available health-based exposure guidance values for di(2-ethylhexyl)phthalate (DEHP) from Health Canada, the United States Environmental Protection Agency (U.S. EPA), the Agency for Toxic Substances and Disease Registry (ATSDR), the European Chemicals Bureau (ECB), and the European Food Safety Authority (EFSA).
Cytowania: 44Influential: 5$ PaywallDOI ↗
(1982) · National Toxicology Program technical report series
AI Summary
Di(2-ethylhexyl)phthalate was carcinogenic for F344 rats and B6C3F1 mice, causing increased incidences of female rats and male and female mice with hepatocellular carcinomas, and inducing an increased incidence of male rats with either hepato cell carcinomas or neoplastic nodules.
Cytowania: 43Influential: 3$ PaywallPubMed ↗

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
Bis(2-ethylhexyl) phthalate · 117-81-7 · Di(2-ethylhexyl) phthalate · Di(2-ethylhexyl)phthalate · Etalon · Ethylhexyl phthalate · Vinicizer 80 · Dioctylphthalate · Hercoflex 260 · Nuoplaz dop · RC plasticizer DOP · Hatcol dop · Reomol dop · Sansocizer DOP · Ergoplast FDO
Data sources
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