1,1,3,3-Tetramethylbutyl peroxyneodecanoate

Base Information

• Chemical Name: 1,1,3,3-Tetramethylbutyl peroxyneodecanoate
• CAS No.: 51240-95-0
• Deprecated CAS: 149270-29-1
• Molecular Formula: C18H36 O3
• Molecular Weight: 314.4602
• European Community (EC) Number: 257-077-0
• DSSTox Substance ID: DTXSID20933604
• Wikidata: Q82909434
• Mol file: 51240-95-0.mol

Synonyms:1,1,3,3-Tetramethylbutyl peroxyneodecanoate;EINECS 257-077-0;51240-95-0;2,4,4-trimethylpentan-2-yl 3-(5,5-dimethylhexyl)dioxirane-3-carboxylate;EC 257-077-0;Neodecaneperoxoic acid, 1,1,3,3-tetramethylbutyl ester;SCHEMBL1069901;DTXSID20933604;A828502;2,4,4-trimethylpentan-2-yl 3-(5,5-dimethylhexyl)-1,2-dioxirane-3-carboxylate;3-(5,5-dimethylhexyl)-3-dioxiranecarboxylic acid 2,4,4-trimethylpentan-2-yl ester;149270-29-1

Chemical Property of 1,1,3,3-Tetramethylbutyl peroxyneodecanoate

Chemical Property:

• Vapor Pressure: 0.000134mmHg at 25°C
• Boiling Point: 333.8 °C at 760 mmHg
• Flash Point: 137.2 °C
• PSA: 51.36000
• Density: 0.971 g/cm³
• LogP: 5.00900
• Water Solubility.: 33.6μg/L at 20℃
• XLogP3: 6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 314.24570956
• Heavy Atom Count: 22
• Complexity: 381

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)CCCCC1(OO1)C(=O)OC(C)(C)CC(C)(C)C

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