Phosphonic acid, [phenyl[(phenylmethyl)amino]methyl]-, diethyl ester

Base Information

• Chemical Name: Phosphonic acid, [phenyl[(phenylmethyl)amino]methyl]-, diethyl ester
• CAS No.: 63000-01-1
• Molecular Formula: C18H24NO3P
• Molecular Weight: 333.367
• DSSTox Substance ID: DTXSID50453204
• Nikkaji Number: J876.040C
• Mol file: 63000-01-1.mol

Synonyms:63000-01-1;Phosphonic acid, [phenyl[(phenylmethyl)amino]methyl]-, diethyl ester;SCHEMBL11663322;DTXSID50453204;STK976594;diethyl phenyl(benzylamino)methylphosphonate;diethyl [(benzylamino)(phenyl)methyl]phosphonate;alpha-(Benzylamino)benzylphosphonic acid diethyl ester

Chemical Property of Phosphonic acid, [phenyl[(phenylmethyl)amino]methyl]-, diethyl ester

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 333.14938063
• Heavy Atom Count: 23
• Complexity: 355

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOP(=O)(C(C1=CC=CC=C1)NCC2=CC=CC=C2)OCC

Technology Process of Phosphonic acid, [phenyl[(phenylmethyl)amino]methyl]-, diethyl ester

There total 20 articles about Phosphonic acid, [phenyl[(phenylmethyl)amino]methyl]-, diethyl ester 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: 99.0%

benzaldehyde (100-52-7) + phosphonic acid diethyl ester (762-04-9) + benzylamine (100-46-9) → diethyl 1-(N-benzylamino)-1-phenylmethylphosphonate (63000-01-1)

Guidance literature:

With magnesium(II) perchlorate; air; at 50 ℃; for 12h;

DOI:10.1039/b602536f

Reference yield: 97.0%

N-benzylbenzamide (1485-70-7) + phosphonic acid diethyl ester (762-04-9) → diethyl 1-(N-benzylamino)-1-phenylmethylphosphonate (63000-01-1)

Guidance literature:

With Schwartz's reagent; In tetrahydrofuran; at 60 ℃; for 12h; Solvent; Temperature; Time; Inert atmosphere; Schlenk technique;

DOI:10.1021/ol4019419

Reference yield: 95.0%

benzaldehyde (100-52-7) + benzylamine (100-46-9) + triethyl phosphite (122-52-1) → diethyl 1-(N-benzylamino)-1-phenylmethylphosphonate (63000-01-1)

Guidance literature:

[Cu(tetramethyl-tetra-3,4-pyridinoporphyrazinato)](MeSO₄)4; In water; at 80 ℃; for 1h;

DOI:10.1016/j.jorganchem.2008.07.037

upstream raw materials:

N-benzylidene benzylamine

phosphonic acid diethyl ester

Diethyl phosphonate

benzaldehyde

Downstream raw materials:

(R,S)-<α-(Benzylamino)benzyl>phosphonsaeure

diethyl 1-aminophenylmethylphosphonate

{[Benzyl-(2-chloro-acetyl)-amino]-phenyl-methyl}-phosphonic acid diethyl ester

2-(benzyl((diethoxyphosphoryl)-(phenyl)methyl)amino)-2-(thiophen-2-yl) acetic acid