Diethyl (3-methylbutyl)phosphonate

Base Information

Chemical Name:Diethyl (3-methylbutyl)phosphonate
CAS No.:90795-87-2
Molecular Formula:C9H21O3P
Molecular Weight:208.238
Hs Code.:
DSSTox Substance ID:DTXSID90548022
Wikidata:Q82426598

Synonyms:90795-87-2;Diethyl (3-methylbutyl)phosphonate;SCHEMBL10590815;DTXSID90548022

Suppliers and Price of Diethyl (3-methylbutyl)phosphonate

Supply Marketing:

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

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Chemical Property of Diethyl (3-methylbutyl)phosphonate

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:208.12283153
Heavy Atom Count:13
Complexity:158

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOP(=O)(CCC(C)C)OCC

Technology Process of Diethyl (3-methylbutyl)phosphonate

There total 1 articles about Diethyl (3-methylbutyl)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:

: 107-82-4
i-pentyl bromide

: 122-52-1
triethyl phosphite

: 78-38-6
ethylphosphonic acid diethyl ester

: 90795-87-2
diethyl (3-methylbutyl)phosphonate

Guidance literature:: In neat (no solvent); at 340 ℃; for 0.0166667h; under 25858.1 Torr; Temperature; Time; Flow reactor;
DOI:10.1021/acs.oprd.1c00472

Reference yield: 39.0%

: 100-48-1
pyridine-4-carbonitrile

: 90795-87-2
diethyl (3-methylbutyl)phosphonate

: 32085-88-4
3,5-difluorobenzaldehyde

: 103173-54-2
amidino-acetic acid methyl ester hydrochloride

: [4-(3,5-difluoro-phenyl)-5-isobutyl-6-pyridin-4-yl-pyrimidin-2-yl]-acetic acid methyl ester

Guidance literature:: pyridine-4-carbonitrile; diethyl (3-methylbutyl)phosphonate; With n-butyllithium; In 1,4-dioxane; hexane; at -30 ℃; for 0.5h;

3,5-difluorobenzaldehyde; In 1,4-dioxane; hexane; at -30 - 40 ℃; for 2h;

amidino-acetic acid methyl ester hydrochloride; With N-ethyl-N,N-diisopropylamine; In 1,4-dioxane; hexane; for 6h; Heating;
DOI:10.1016/j.tetlet.2005.01.068