Ethaneperoxoic acid, phenoxy-, 1,1,3,3-tetramethylbutyl ester

Base Information

• Chemical Name: Ethaneperoxoic acid, phenoxy-, 1,1,3,3-tetramethylbutyl ester
• CAS No.: 59382-51-3
• Deprecated CAS: 81827-35-2
• Molecular Formula: C16H24O4
• Molecular Weight: 280.35936
• European Community (EC) Number: 261-726-3
• UNII: D5KZQ9F29Q
• DSSTox Substance ID: DTXSID1069326
• Nikkaji Number: J298.136J
• Wikidata: Q81996177
• Mol file: 59382-51-3.mol

Synonyms:Ethaneperoxoic acid, phenoxy-, 1,1,3,3-tetramethylbutyl ester;59382-51-3;1,1,3,3-Tetramethylbutyl phenoxyperoxyacetate;2,4,4-trimethylpentan-2-yl 2-phenoxyethaneperoxoate;EINECS 261-726-3;Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester;D5KZQ9F29Q;DTXSID1069326;1,1,3,3-Tetramethylbutyl 2-phenoxyethaneperoxoate;Phenoxyperacetic acid 1,1,3,3-tetramethylbutyl ester

Chemical Property of Ethaneperoxoic acid, phenoxy-, 1,1,3,3-tetramethylbutyl ester

Chemical Property:

• Refractive Index: 1.485
• Boiling Point: 347.1±44.0 °C(Predicted)
• PSA: 44.76000
• Density: 1.030±0.06 g/cm3(Predicted)
• LogP: 3.75500
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 280.16745924
• Heavy Atom Count: 20
• Complexity: 298

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)CC(C)(C)OOC(=O)COC1=CC=CC=C1

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