Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate

Base Information Edit

Chemical Name:Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate
CAS No.:116384-53-3
Molecular Formula:C12H20N5O4P
Molecular Weight:329.296
Hs Code.:2933990090
European Community (EC) Number:601-426-5
DSSTox Substance ID:DTXSID90332903
Nikkaji Number:J592.481B
Wikidata:Q72441372
ChEMBL ID:CHEMBL55800
Mol file:116384-53-3.mol

Synonyms:116384-53-3;Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate;[[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonic acid diethyl ester;9-[2-(Diethylphosphonomethoxy)ethyl]adenine;9-[2-(diethoxyphosphorylmethoxy)ethyl]purin-6-amine;PMEA diethyl ester;Adefovir-d4DiethylEster;MFCD07783825;Diethyl [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonate;diethyl {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonate;9-[2-(Diethoxyphosphorylmethoxy)ethyl]adenine;CHEMBL55800;SCHEMBL3302566;Diethyl [[2-(6-Amino-9-purinyl)ethoxy]methyl]phosphonate;DTXSID90332903;BCP22949;AKOS015895099;AC-3498;AS-73361;SY053319;CS-0441520;D4256;FT-0642832;9-[2-(diethylphosphonomethoxy)ethyl] adenine;Diethyl-9-[2-(phosphonomethoxy)ethyl]adenine;T70112;A803608;W-200895;diethyl (2-(6-amino-9H-purin-9-yl)ethoxy)methylphosphonate;9-[2-[(Diethoxyphosphinyl)methoxy]ethyl]-9H-purine-6-amine;Diethyl((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate;Diethyl P-((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate;Phosphonic acid, P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-, diethyl ester

Suppliers and Price of Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
9-[2-(Diethylphosphonomethoxy)ethyl]adenine
500mg
$ 75.00

TRC
9-[2-(Diethylphosphonomethoxy)ethyl]adenine
50mg
$ 45.00

TCI Chemical
Diethyl [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonate >95.0%(HPLC)(T)
5g
$ 45.00

TCI Chemical
Diethyl [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonate >95.0%(HPLC)(T)
1g
$ 27.00

Matrix Scientific
Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate 95+%
5g
$ 460.00

Matrix Scientific
Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate 95+%
1g
$ 115.00

Frontier Specialty Chemicals
9-[2-(Diethylphosphonomethoxy)ethyl]adenine 95%
1g
$ 104.00

Frontier Specialty Chemicals
9-[2-(Diethylphosphonomethoxy)ethyl]adenine 95%
5g
$ 333.00

Crysdot
Diethyl [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonate 95+%
100g
$ 627.00

Chemenu
Diethyl [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonate 95%
100g
$ 592.00

Total 95 raw suppliers

Chemical Property of Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate Edit

Chemical Property:

Appearance/Colour:light yellow liquid
Vapor Pressure:2.32E-11mmHg at 25°C
Melting Point:134.0 to 138.0 °C
Refractive Index:1.619
Boiling Point:531.1 ºC at 760 mmHg
PKA:4.18±0.10(Predicted)
Flash Point:275 ºC
PSA：124.19000
Density:1.45 g/cm³
LogP:2.22990
XLogP3:-0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:329.12529113
Heavy Atom Count:22
Complexity:379

Purity/Quality:

99% ^*data from raw suppliers

9-[2-(Diethylphosphonomethoxy)ethyl]adenine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOP(=O)(COCCN1C=NC2=C(N=CN=C21)N)OCC

Technology Process of Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate

There total 27 articles about Diethyl ((2-(6-amino-9H-purin-9-yl)ethoxy)methyl)phosphonate 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: 89.0%

: O,O-diethyl((2-(6-(benzylamino)-9H-purin-9-yl)ethoxy)methyl)phosphonate

: 116384-53-3
[[2-(6-amino-9H-purine-9-yl)ethoxy]methyl]phosphonic acid diethyl ester

Guidance literature:: With 5%-palladium/activated carbon; hydrogen; In ethanol; at 20 ℃; for 24h; under 760.051 Torr; regioselective reaction;
DOI:10.3762/bjoc.15.77