1-(2,2-Dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxylic acid

Base Information

Chemical Name:1-(2,2-Dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxylic acid
CAS No.:293329-57-4
Molecular Formula:C15H16N2O5
Molecular Weight:304.302
Hs Code.:
DSSTox Substance ID:DTXSID20471137
Wikidata:Q82299565

Synonyms:293329-57-4;1-(2,2-DIMETHOXYETHYL)-6-OXO-2-PHENYL-1,6-DIHYDROPYRIMIDINE-5-CARBOXYLIC ACID;SCHEMBL7072736;DTXSID20471137;DOJSSBPIYKYGMJ-UHFFFAOYSA-N;FT-0757003;1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid

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Supply Marketing:

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

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Chemical Property of 1-(2,2-Dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxylic acid

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:304.10592162
Heavy Atom Count:22
Complexity:490

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(CN1C(=NC=C(C1=O)C(=O)O)C2=CC=CC=C2)OC

Technology Process of 1-(2,2-Dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxylic acid

There total 4 articles about 1-(2,2-Dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidine-5-carboxylic acid 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: 63.0%

: 308276-58-6
methyl 1-(2,2-dimethoxyethyl)-1,6-dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylate

: 293329-57-4
1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid

Guidance literature:: methyl 1-(2,2-dimethoxyethyl)-1,6-dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylate; With pyridine; lithium iodide; at 20 ℃; for 2h; Heating / reflux;

With hydrogenchloride; In water;

Reference yield:

: 139721-85-0
α-chlorophenylformamidine hydrochloride

: 293329-57-4
1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: methanol / 72 h / 5 °C

2: methanol / 1.5 h / 100 °C

3: pyridine, lithium iodide / 2 h / Heating

With pyridine; lithium iodide; In methanol;
DOI:10.1021/jm00001a015

Reference yield:

: 100-47-0
benzonitrile

: 293329-57-4
1-(2,2-dimethoxyethyl)-6-oxo-2-phenyl-1,6-dihydropyrimidin-5-ylcarboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1: HCl / ethanol / 16 h / Ambient temperature

2: methanol / 72 h / 5 °C

3: methanol / 1.5 h / 100 °C

4: pyridine, lithium iodide / 2 h / Heating

With pyridine; hydrogenchloride; lithium iodide; In methanol; ethanol;
DOI:10.1021/jm00001a015