m-Diisopropylbenzene dihydroperoxide

Base Information

• Chemical Name: m-Diisopropylbenzene dihydroperoxide
• CAS No.: 721-26-6
• Molecular Formula: C12H18 O4
• Molecular Weight: 226.273
• European Community (EC) Number: 615-720-6
• DSSTox Substance ID: DTXSID40992819
• Nikkaji Number: J664.810J
• Wikidata: Q82983256
• Mol file: 721-26-6.mol

Synonyms:m-Diisopropylbenzene dihydroperoxide;721-26-6;Dihydroperoxide meta-diisopropylbenzene;BRN 2053313;1,3-bis(2-hydroperoxypropan-2-yl)benzene;Hydroperoxide, (m-phenylenediisopropylidene)di-;(alpha,alpha,alpha',alpha'-Tetramethyl-m-xylylene)bishydroperoxide;SCHEMBL2969176;DTXSID40992819;m-di-(2-hydroperoxy-2-propyl)-benzene;LS-77276;1,3-Bis(1-hydroperoxy-1-methylethyl)benzene;2,2'-(1,3-Phenylene)di(propane-2-peroxol)

Chemical Property of m-Diisopropylbenzene dihydroperoxide

Chemical Property:

• Vapor Pressure: 2.4E-06mmHg at 25°C
• Melting Point: 61 °C
• Boiling Point: 376.8°C at 760 mmHg
• PKA: 11.84±0.30(Predicted)
• Flash Point: 181.7°C
• PSA: 86.58000
• Density: 1.145g/cm³
• LogP: 3.71320
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 226.12050905
• Heavy Atom Count: 16
• Complexity: 203

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1=CC(=CC=C1)C(C)(C)OO)OO

Technology Process of m-Diisopropylbenzene dihydroperoxide

There total 8 articles about m-Diisopropylbenzene dihydroperoxide 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: 66.1%

1,3-diisopropylbenzene (99-62-7) + 3-isopropyl-1-(2-hydroperoxy-2-propyl)benzene (80-24-0) → 1,3-di(2-hydroperoxy-2-propyl)benzene (721-26-6)

Guidance literature:

With oxygen; In water; at 83 - 92 ℃; for 10h; under 2250.23 Torr; pH=9 - 11; Product distribution / selectivity;

Reference yield:

1,3-diisopropylbenzene (99-62-7) → 3-(2-hydroxy-2-propyl)-1-(2-hydroperoxy-2-propyl)benzene (13387-60-5) + 3-isopropyl-1-(2-hydroperoxy-2-propyl)benzene (80-24-0) + 1,3-di(2-hydroperoxy-2-propyl)benzene (721-26-6)

Guidance literature:

With oxygen; amino acids copper salts; at 110 ℃; Product distribution; var. catalysts, selectivity of catalysts;

Reference yield:

1,3-diisopropylbenzene (99-62-7) → 3-isopropyl-1-(2-hydroperoxy-2-propyl)benzene (80-24-0) + 1,3-di(2-hydroperoxy-2-propyl)benzene (721-26-6)

Guidance literature:

With air; sodium carbonate; at 90 ℃;

upstream raw materials:

1,3-diisopropylbenzene

oxygen

3-(2-hydroxy-2-propyl)-1-(2-hydroperoxy-2-propyl)benzene

3-isopropyl-1-(2-hydroperoxy-2-propyl)benzene

Downstream raw materials:

acetone

recorcinol

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