Phosphazene base P1-t-Oct

Base Information

• Chemical Name: Phosphazene base P1-t-Oct
• CAS No.: 161118-69-0
• Molecular Formula: C₁₄H₃₅N₄P
• Molecular Weight: 290.432
• European Community (EC) Number: 625-082-0
• DSSTox Substance ID: DTXSID90408011
• Nikkaji Number: J1.469.040I
• Wikidata: Q82213368
• Mol file: 161118-69-0.mol

Synonyms:Phosphazene base P1-t-Oct;161118-69-0;tert-octyliminotris(dimethylamino)phosphorane;N-[bis(dimethylamino)-(2,4,4-trimethylpentan-2-ylimino)-lambda5-phosphanyl]-N-methylmethanamine;Phosphorimidic triamide, N,N,N',N',N'',N''-hexamethyl-N'''-(1,1,3,3-tetramethylbutyl)-;tert-Octylimino-tris(dimethylamino)phosphorane;SCHEMBL676262;PHOSPHAZENEBASEP1-T-OCT;DTXSID90408011;AKOS024287094;Phosphazene base P1-t-Oct, >=97.0%;t-octylimino-tris(dimethylamino)phosphorane;J-009788;1,1,3,3-Tetramethylbutyliminotris(dimethylamino)phosphorane

Chemical Property of Phosphazene base P1-t-Oct

Chemical Property:

• Vapor Pressure: 0.000135mmHg at 25°C
• Refractive Index: n20/D 1.474
• Boiling Point: 68 °C0.05 mm Hg(lit.)
• Flash Point: 155.5°C
• PSA: 31.89000
• Density: 0.91g/cm³
• LogP: 3.83220
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 290.25993413
• Heavy Atom Count: 19
• Complexity: 309

Purity/Quality:

97% ^*data from raw suppliers

Phosphazene base P1-t-Oct ≥97.0% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)(C)CC(C)(C)N=P(N(C)C)(N(C)C)N(C)C
• Uses: Phosphazene Bases: a Family of Extremely Strong, Non-Ionic, Non-Charged Nitrogen–Bases

Technology Process of Phosphazene base P1-t-Oct

There total 5 articles about Phosphazene base P1-t-Oct 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: 97.0%

dimethyl amine (124-40-3) + (1,1,3,3-tetramethylbutylimino)phosphorus trichloride (153136-07-3) → tert-octyliminotris(dimethylamino)phosphorane (161118-69-0)

Guidance literature:

With potassium hydroxide; In tetrahydrofuran; 1.) -70 deg C, 3 h; -70 deg C to r.t., 12 h;

Reference yield: 65.0%

C14H35N6P (1430747-00-4) → tert-octyliminotris(dimethylamino)phosphorane (161118-69-0)

Guidance literature:

at 145 ℃; for 115h; Inert atmosphere;

DOI:10.1002/ejoc.201201400

Reference yield:

2,4,4-trimethyl-1-pentene (107-39-1) → tert-octyliminotris(dimethylamino)phosphorane (161118-69-0)

Guidance literature:

Multi-step reaction with 3 steps

1: sulfuric acid; sodium azide / water / 240 h

2: 0 - 40 °C / Inert atmosphere

3: 115 h / 145 °C / Inert atmosphere

With sodium azide; sulfuric acid; In water;

DOI:10.1002/ejoc.201201400

upstream raw materials:

dimethyl amine

(1,1,3,3-tetramethylbutylimino)phosphorus trichloride

(1,1,3,3-tetramethylbutyl)ammonium chloride

2-azido-2,4,4-trimethylpentane