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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Tetrabenzoato de pentaeritritol - ≥95,5%(HPLC) , CAS No.4196-86-5
Synonyms
1,3-Propanediol, 2,2-bis((benzoyloxy)methyl)-, dibenzoate | STK366686 | 2,2-bis(benzoyloxymethyl)propane-1,3-diyl dibenzoate | Uniplex 552 | Pentaerythritol tetrabenzoate | 3-(Benzoyloxy)-2,2-bis[(benzoyloxy)methyl]propyl benzoate | AM85762 | Benzoflex S-
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Why this grade ≥95,5%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
1, 3-Propanediol, 2, 2-bis((benzoyloxy)methyl)-, dibenzoate | STK366686 | 2, 2-bis(benzoyloxymethyl)propane-1, 3-diyl dibenzoate | Uniplex 552 | Pentaerythritol tetrabenzoate | 3-(Benzoyloxy)-2, 2-bis[(benzoyloxy)methyl]propyl benzoate | AM85762 | Benzoflex S-
Especificaciones y pureza
≥95, 5%(HPLC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488182592 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488182592 Sonrisas canónicas C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)(COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4 IUPAC Name [3-benzoyloxy-2,2-bis(benzoyloxymethyl)propyl] benzoate InChIKey MINJAOUGXYRTEI-UHFFFAOYSA-N INCHI 1S/C33H28O8/c34-29(25-13-5-1-6-14-25)38-21-33(22-39-30(35)26-15-7-2-8-16-26,23-40-31(36)27-17-9-3-10-18-27)24-41-32(37)28-19-11-4-12-20-28/h1-20H,21-24H2 Isómeros SMILES C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)(COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4 WGK Alemania 3 RTECS RZ2605000 PubChem CID 20167 Peso molecular 552.58 Beilstein 9144 Reaxy-Rn 3513249
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organic acids and derivatives Clase Carboxylic acids and derivatives Subclass Tetracarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Tetracarboxylic acids and derivatives Alternative Parents Benzoic acid esters Benzoyl derivatives Carboxylic acid esters Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Tetracarboxylic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Benzenoid - Monocyclic benzene moiety - Carboxylic acid ester - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as tetracarboxylic acids and derivatives. These are carboxylic acids containing exactly four carboxyl groups. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Insoluble in water; Soluble in Methanol Punto de fusión (°C) 102-104°C Peso molecular 552.600 g/mol XLogP3 6.500 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 16 Exact Mass 552.178 Da Monoisotopic Mass 552.178 Da Topological Polar Surface Area 105.000 Ų Heavy Atom Count 41 Formal Charge 0 Complexity 704.000 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
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