Tris(2,4-di-tert-butylphenyl) phosphite

CAS 31570-04-4  ·  C42H63O3P  ·  MW 646.9 g/mol

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3D model Tris(2,4-di-tert-butylphenyl) phosphite, CAS 31570-04-4, molecular formula C42H63O3P, molar mass 646.9 g/mol
About Tris(2,4-di-tert-butylphenyl) phosphite

Tris(2,4-di-tert-butylphenyl) phosphite is a chemical compound registered under number CAS 31570-04-4, with the molecular formula C42H63O3P, and a molar mass of 646.9 g/mol.

The molecule contains 109 atoms connected by 111 chemical bonds. The full systematic IUPAC name of this compound is tris(2,4-ditert-butylphenyl) phosphite. 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 = 15.5 (positive value, a lipophilic compound), polar surface area PSA = 27.7 Ų, 0 donors and 3 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
Molecular formulaC42H63O3P
Masa molowa646.9 g/mol
IUPACtris(2,4-ditert-butylphenyl) phosphite
SMILESCC(C)(C)C1=CC(=C(C=C1)OP(OC2=C(C=C(C=C2)C(C)(C)C)C(C)(C)C)OC3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChIKeyJKIJEFPNVSHHEI-UHFFFAOYSA-N
logP (XLogP3)15.5
PSA27.7 Ų
HBD / HBA0 / 3
PubChem CIDCID 91601 ↗
Scientific literature

Related literature

3 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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📈 Publication timeline (3 articles)

1999: 1 articles19992023: 1 articles20232024: 1 articles2024

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

Synonyms
31570-04-4 · Tris(2,4-di-tert-butylphenyl) phosphite · Tris(2,4-ditert-butylphenyl) phosphite · Tris(2,4-di-tert-Butylphenyl)phosphite · 834E5H0LFF · IRGAFOS-168 · Phenol, 2,4-bis(1,1-dimethylethyl)-, phosphite (3:1) · DOVERPHOS S 480 · EVERFOS 168 · tris-(2,4-di-tert-butylphenyl) phosphite · JP-650 · 250-709-6 · RefChem:900160 · DTXCID907969 · Irgafos 168
Data sources
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License & Provenance

MolGod 3D molecular model
Tris(2,4-di-tert-butylphenyl) phosphite — CAS 31570-04-4

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

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Tris(2,4-di-tert-butylphenyl) phosphite (CAS 31570-04-4) — License & Provenance

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Tris(2,4-di-tert-butylphenyl) phosphite (CAS 31570-04-4) — MolGod molecule record

Source data: PubChem CID 91601

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Source data: PubChem CID 91601

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