[(6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic acid

Base Information

Chemical Name:[(6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic acid
CAS No.:91194-51-3
Molecular Formula:C₁₁H₁₇N₃O₄S
Molecular Weight:287.34
Hs Code.:
NSC Number:70508
DSSTox Substance ID:DTXSID40290721
Wikidata:Q82028499

Synonyms:91194-51-3;NSC70508;[(6-amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic acid;DTXSID40290721;NSC-70508;2-((6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)thio)acetic acid;2-((6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)thio)aceticacid

Suppliers and Price of [(6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic acid

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 3 raw suppliers

Chemical Property of [(6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic acid

Chemical Property:

Vapor Pressure:3.58E-08mmHg at 25°C
Boiling Point:418.4°Cat760mmHg
Flash Point:206.8°C
Density:1.4g/cm³
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:287.09397721
Heavy Atom Count:19
Complexity:436

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCN1C(=C(C(=O)N(C1=O)CC)SCC(=O)O)N

Technology Process of [(6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic acid

There total 1 articles about [(6-Amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidin-5-yl)sulfanyl]acetic 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:

: 91194-51-3
(6-amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-pyrimidin-5-ylsulfanyl)-acetic acid

Guidance literature:: 1-Propyl-3-aethyl-5-chlor-6-amino-uracil, 80percentig. wss. Mercaptoessigsaeure, 90grad, 0.5h;
DOI:10.1021/ja00869a028

Reference yield:

: 91194-51-3
(6-amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-pyrimidin-5-ylsulfanyl)-acetic acid

: 3950-00-3
1-Propyl-3-aethyl-1H-pyrimido <5.4-b><1.4> thiazin-2,4,7(3H,6H,8H)-trion

Guidance literature:: With acetic anhydride; Heating;
DOI:10.1021/ja00869a028

Reference yield:

: 91194-51-3
(6-amino-3-ethyl-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-pyrimidin-5-ylsulfanyl)-acetic acid

: 94581-93-8
1-Propyl-3-ethyl-6-ethoxy-1H-pyrimido<5.4-b><1.4>thiazin-2.4.7(3H.6H.8H)-trion-5-oxid

Guidance literature:: Multi-step reaction with 4 steps

1: Ac₂O / Heating

2: Br₂, NaHCO₃ / CHCl₃

3: Heating

4: AcOOH / acetic acid

With peracetic acid; bromine; acetic anhydride; sodium hydrogencarbonate; In chloroform; acetic acid;
DOI:10.1021/ja00869a028