5H-phenophosphazinine 10-oxide

Base Information

• Chemical Name: 5H-phenophosphazinine 10-oxide
• CAS No.: 53778-28-2
• Molecular Formula: C12H10NOP
• Molecular Weight: 215.191
• NSC Number: 666488
• DSSTox Substance ID: DTXSID70422593
• Wikidata: Q82234544
• ChEMBL ID: CHEMBL1993277
• Mol file: 53778-28-2.mol

Synonyms:NSC666488;5H-phenophosphazinine 10-oxide;5,10-Dihydrophenophosphazine 10-oxide;53778-28-2;CHEMBL1993277;DTXSID70422593;AKOS024365202;NSC-666488;NCI60_023149

Chemical Property of 5H-phenophosphazinine 10-oxide

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 214.042175908
• Heavy Atom Count: 15
• Complexity: 244

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)NC3=CC=CC=C3[P+]2=O

Technology Process of 5H-phenophosphazinine 10-oxide

There total 2 articles about 5H-phenophosphazinine 10-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: 25.0%

diphenylamine (122-39-4) → 10-phenyl-5,10-dihydrophenophosphazine (79722-69-3) + 10-phenyl-5,10-dihydrophenophosphazine 10-oxide (73785-73-6) + 5,10-dihydro phenophosphazine-10-oxide (53778-28-2)

Guidance literature:

With sodium hydroxide; Dichlorophenylphosphine; Yield given. Multistep reaction; 1.) 200 - 220 deg C, 60 min, 2.) H₂O, reflux, 40 min;

Reference yield: 14.0%

Dichlorophenylphosphine (644-97-3) + diphenylamine (122-39-4) → 10-phenyl-5,10-dihydrophenophosphazine (79722-69-3) + 10-phenyl-5,10-dihydrophenophosphazine 10-oxide (73785-73-6) + 5,10-dihydro phenophosphazine-10-oxide (53778-28-2)

Guidance literature:

at 200 - 220 ℃; for 1h;

Reference yield: 69.0%

benzyl chloride (100-44-7) + 5,10-dihydro phenophosphazine-10-oxide (53778-28-2) → 10-benzyl-5,10-dihydrophenophosphazine-10-oxide (121211-85-6)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; at 50 ℃; for 1h;

DOI:10.1021/jo00275a047

upstream raw materials:

Dichlorophenylphosphine

diphenylamine

Downstream raw materials:

N-[(10-oxo-5,10-dihydro-10λ⁵-phenophosphazin-10-yl)-phenyl-methyl]-aniline

(10-oxo-5,10-dihydro-10λ⁵-phenophosphazin-10-yl)-phenyl-methanol

2-(10-oxo-5,10-dihydro-10λ⁵-phenophosphazin-10-yl)-1,4-diphenyl-butane-1,4-dione

N-[(10-oxo-5,10-dihydro-10λ⁵-phenophosphazin-10-yl)-phenyl-methyl]-benzenesulfonamide

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