2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate)

Base Information

• Chemical Name: 2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate)
• CAS No.: 178671-58-4
• Molecular Formula: C₆₉H₄₈N₄O₈
• Molecular Weight: 1061.16
• European Community (EC) Number: 429-160-3,639-996-2
• UNII: P428PY6477
• DSSTox Substance ID: DTXSID70170522
• Nikkaji Number: J1.962.905H
• Wikidata: Q27286103
• Mol file: 178671-58-4.mol

Synonyms:178671-58-4;2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate);Uvinul 3030;UV 3030;UV-3030;P428PY6477;2-Propenoic acid, 2-cyano-3,3-diphenyl-2,2-bis(((2-cyano-1-oxo-3,3-diphenyl-2-propenyl)oxy)methyl)-1,3-propanediyl ester;[3-(2-cyano-3,3-diphenylprop-2-enoyl)oxy-2,2-bis[(2-cyano-3,3-diphenylprop-2-enoyl)oxymethyl]propyl] 2-cyano-3,3-diphenylprop-2-enoate;1,3-Bis((2-cyano-3,3-diphenylacryloyl)oxy)-2,2-bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane;2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)-propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate);2-Propenoic acid, 2-cyano-3,3-diphenyl-, 1,1'-(2,2-bis(((2-cyano-1-oxo-3,3-diphenyl-2-propen-1-yl)oxy)methyl)-1,3-propanediyl) ester;2-Propenoic acid, 2-cyano-3,3-diphenyl-, 1,1'-[2,2-bis[[(2-cyano-1-oxo-3,3-diphenyl-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester;2-Propenoic acid, 2-cyano-3,3-diphenyl-, 2,2-bis(((2-cyano-1-oxo-3,3-diphenyl-2-propenyl)oxy)methyl)-1,3-propanediyl ester;UNII-P428PY6477;CVSXFBFIOUYODT-UHFFFAOYSA-N;C69H48N4O8;UV Absorber 3030;SCHEMBL124488;DTXSID70170522;MFCD21607536;AKOS016007524;DS-18062;CS-0156577;NS00003527;D82511;A924985;Q27286103;2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diylbis(2-cyano-3,3-diphenylacrylate);2,2-Bis(((2-cyano-33-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate);2-cyano-3,3-diphenyl-2,2-bis(((2-cyano-1-oxo-3,3-diphenyl-2-propenyl)oxy)methyl)-1,3-propanediyl ester2-propenoic acid

Chemical Property of 2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate)

Chemical Property:

• Boiling Point: 1077.363 °C at 760 mmHg
• Flash Point: 418.445 °C
• PSA: 191.13000
• Density: 1.268 g/cm³
• LogP: 12.39720
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Acetone (Sightly, Heated), DMSO (Sparingly, Heated)
• XLogP3: 15.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 24
• Exact Mass: 1060.34721450
• Heavy Atom Count: 81
• Complexity: 2070

Purity/Quality:

99% ^*data from raw suppliers

Uvinul3030 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=C(C#N)C(=O)OCC(COC(=O)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C#N)(COC(=O)C(=C(C4=CC=CC=C4)C5=CC=CC=C5)C#N)COC(=O)C(=C(C6=CC=CC=C6)C7=CC=CC=C7)C#N)C8=CC=CC=C8
• Uses: Uvinul 3030 is used as an analyte for detectioni and identification of leachables in vaccines from plastic packaging materials using UPLC-QTOF MS with self-built polymer additives library.

Technology Process of 2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate)

There total 4 articles about 2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate) which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.6%

Pentaerythritol (115-77-5) + etocrylene (5232-99-5) → pentaerythritol tetrakis(2-cyano-3,3-diphenylacrylate) (178671-58-4)

Guidance literature:

With sodium methylate; In 5,5-dimethyl-1,3-cyclohexadiene; for 12h; Reagent/catalyst; Reflux;

Reference yield: 75.4%

Pentaerythritol (115-77-5) + methyl α-cyano-β,β-diphenyl acrylate (14442-37-6) → pentaerythritol tetrakis(2-cyano-3,3-diphenylacrylate) (178671-58-4)

Guidance literature:

With lithium hydroxide; at 175 ℃; for 15h; under 600 - 700 Torr;

Reference yield:

benzophenone (119-61-9) → pentaerythritol tetrakis(2-cyano-3,3-diphenylacrylate) (178671-58-4)

Guidance literature:

Multi-step reaction with 2 steps

1: ammonium acetate; pyrographite / n-heptane / 15 h / Ionic liquid; Reflux

2: sodium methylate / 5,5-dimethyl-1,3-cyclohexadiene / 12 h / Reflux

With ammonium acetate; sodium methylate; pyrographite; In 5,5-dimethyl-1,3-cyclohexadiene; n-heptane;

upstream raw materials:

Pentaerythritol

methyl α-cyano-β,β-diphenyl acrylate

etocrylene

benzophenone

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