1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide

Base Information

• Chemical Name: 1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide
• CAS No.: 854929-36-5
• Molecular Formula: C₂₆H₃₉N₂OP
• Molecular Weight: 426.582
• DSSTox Substance ID: DTXSID90479504
• Wikidata: Q82313582
• Mol file: 854929-36-5.mol

Synonyms:854929-36-5;1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide;1,3-bis[2,6-di(propan-2-yl)phenyl]-1,3,2-diazaphospholidin-2-ium 2-oxide;SCHEMBL17961899;DTXSID90479504;MFCD14708169;AKOS025295833;B3479;CS-0085125;T71400;1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine2-Oxide;1,3-Bis-(2,6-diisopropylphenyl)-[1,3,2]diazaphospholidine 2-oxide, 97%;1,3-Bis[2,6-di(propan-2-yl)phenyl]-2-oxo-1,3,2-diazaphospholidin-2-ium

Chemical Property of 1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 201.0 to 205.0 °C
• Boiling Point: 499.3±55.0 °C(Predicted)
• PKA: 2.44±0.20(Predicted)
• PSA: 57.69000
• LogP: 8.29420
• XLogP3: 7.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 425.27217584
• Heavy Atom Count: 30
• Complexity: 495

Purity/Quality:

98% ^*data from raw suppliers

1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2CCN([P+]2=O)C3=C(C=CC=C3C(C)C)C(C)C

Technology Process of 1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide

There total 2 articles about 1,3-Bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine 2-Oxide 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: 65.0%

N,N'-bis(2,6-diisopropylphenyl)ethane-1,2-diamine (134030-22-1) → 1,3-bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine-2-oxide (854929-36-5)

Guidance literature:

With water; phosphorus trichloride; In dichloromethane;

DOI:10.1016/j.cclet.2012.02.004

Reference yield:

2-chloro-1,3-[di-(2,6-diisopropyl)phenyl]-1,3,2-diazaphospholidine (314730-65-9) → 1,3-bis(2,6-diisopropylphenyl)-1,3,2-diazaphospholidine-2-oxide (854929-36-5)

Guidance literature:

With water; In dichloromethane; at 20 ℃;

DOI:10.1002/anie.200462371

upstream raw materials:

2-chloro-1,3-[di-(2,6-diisopropyl)phenyl]-1,3,2-diazaphospholidine

N,N'-bis(2,6-diisopropylphenyl)ethane-1,2-diamine