Diethyl naphthalen-1-ylphosphonate

Base Information

• Chemical Name: Diethyl naphthalen-1-ylphosphonate
• CAS No.: 25944-75-6
• Molecular Formula: C14H17O3P
• Molecular Weight: 264.261
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID70401368
• Nikkaji Number: J275.415K
• Wikidata: Q82204454
• Mol file: 25944-75-6.mol

Synonyms:Diethyl naphthalen-1-ylphosphonate;25944-75-6;Naphthalen-1-yl-phosphonic acid diethyl ester;Diethyl 1-Naphthylphosphonate;SCHEMBL10786887;DTXSID70401368;diethyl (naphthalen-1-yl)phosphonate;MFCD00015770;SY311987;FT-0718046

Chemical Property of Diethyl naphthalen-1-ylphosphonate

Chemical Property:

• Boiling Point: 170 °C(Press: 0.25 Torr)
• PSA: 45.34000
• Density: 1.15±0.1 g/cm3(Predicted)
• LogP: 3.73120
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 264.09153140
• Heavy Atom Count: 18
• Complexity: 295

Purity/Quality:

97% ^*data from raw suppliers

Diethylnaphthalen-1-ylphosphonate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOP(=O)(C1=CC=CC2=CC=CC=C21)OCC

Technology Process of Diethyl naphthalen-1-ylphosphonate

There total 2 articles about Diethyl naphthalen-1-ylphosphonate 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:

naphthalene (91-20-3,71998-51-1,72931-45-4) + phosphonic acid diethyl ester (762-04-9) → Diethyl phosphate (598-02-7) + Tetraethyl pyrophosphate (107-49-3) + diethyl (naphthalen-2-yl)phosphonate (17067-93-5) + diethyl naphthalen-1-ylphosphonate (25944-75-6)

Guidance literature:

With ceric ammonium nitrate; In acetic acid; for 5h; Yield given. Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;

DOI:10.1055/s-1987-28077

Reference yield:

bis(1-naphthyl)sulfide (607-53-4) + phosphonic acid diethyl ester (762-04-9) → naphthalene (91-20-3,71998-51-1,72931-45-4) + diethyl naphthalen-1-ylphosphonate (25944-75-6)

Guidance literature:

With potassium tert-butylate; In N,N-dimethyl-formamide; at 25 ℃; for 20h; Irradiation;

DOI:10.1021/jo00007a034

Reference yield: 46.0%

diethyl naphthalen-1-ylphosphonate (25944-75-6) → 1-naphthyl phosphonic acid (7402-93-9)

Guidance literature:

With trimethylsilyl bromide; at 20 ℃;

DOI:10.1016/j.poly.2018.02.030

upstream raw materials:

naphthalene

phosphonic acid diethyl ester

bis(1-naphthyl)sulfide

Downstream raw materials:

1-naphthyl phosphonic acid

(E)-1-styrylnaphthalene

1-ethoxy-3,4-bis(3-methylphenyl)-1H-naphtho[1,2-c][1,2]oxaphosphinine-1-oxide

3-phenyl-4-methyl-1-ethoxynaphthal[c-1,2]oxaphosphinine 1-oxide

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