5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil

Base Information

Chemical Name:5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil
CAS No.:136160-32-2
Molecular Formula:C16H20N2O3S
Molecular Weight:320.4066
Hs Code.:
DSSTox Substance ID:DTXSID70159711
Nikkaji Number:J522.710K
Wikidata:Q27120390
Metabolomics Workbench ID:56368
ChEMBL ID:CHEMBL38711
Mol file:136160-32-2.mol

Synonyms:5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil;136160-32-2;I-EPU, I-HEPU;1-EtOMe-6PhS-5-i-Pr U;1-(ethoxymethyl)-6-(phenylsulfanyl)-5-(propan-2-yl)pyrimidine-2,4(1h,3h)-dione;1-(ethoxymethyl)-5-isopropyl-6-(phenylsulfanyl)uracil;CHEMBL38711;CHEBI:40152;5-isopropyl-1-(ethoxymethyl)-6-(phenylthio)uracil;DTXSID70159711;BDBM50004119;1-[Ethoxymethyl]-5-isopropyl-6-(phenylthio)uracil;Q27120390;1-(ethoxymethyl)-5-isopropyl-6-phenylsulfanyl-pyrimidine-2,4-dione;1-Ethoxymethyl-5-isopropyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione;1-(ethoxymethyl)-5-(1-methylethyl)-6-(phenylsulfanyl)pyrimidine-2,4(1H,3H)-dione

Suppliers and Price of 5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil

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
Packaging
price

Total 1 raw suppliers

Chemical Property of 5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:1.24g/cm³
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:320.11946368
Heavy Atom Count:22
Complexity:456

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOCN1C(=C(C(=O)NC1=O)C(C)C)SC2=CC=CC=C2

Technology Process of 5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil

There total 3 articles about 5-Isopropyl-1-ethoxymethyl-6-(phenylthio)uracil 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: 65.0%

: 136160-33-3
5-isopropyl-1-ethoxymethyl-6-(phenylthio)-2-thiouracil

: 136160-32-2
5-isopropyl-1-(ethoxymethyl)-6-(phenylthio)uracil

Guidance literature:: With sodium hydroxide; dihydrogen peroxide; for 1h; Ambient temperature;
DOI:10.1021/jm00103a009

Reference yield:

: 18718-34-8
5-isopropyl-2-thiouracil

: 136160-32-2
5-isopropyl-1-(ethoxymethyl)-6-(phenylthio)uracil

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) (NH₄)2SO₄, 1,1,1,3,3,3-hexamethyldisilazane, 2.) CsI / 1.) reflux, 15 h, 2.) MeCN, reflux, 2 h

2: 1.) lithium diisopropylamide (LDA) / 1.) THF, -70 deg C, 1 h, 2.) THF, -70 deg C, 1 h

3: 65 percent / 1 N aq. NaOH, 35percent H₂O₂ / 1 h / Ambient temperature

With ammonium sulfate; sodium hydroxide; isocyanate de chlorosulfonyle; dihydrogen peroxide; 1,1,1,3,3,3-hexamethyl-disilazane; lithium diisopropyl amide;
DOI:10.1021/jm00103a009

Reference yield:

: 144410-21-9
1-(ethoxymethyl)-5-isopropyl-2-thiouracil

: 136160-32-2
5-isopropyl-1-(ethoxymethyl)-6-(phenylthio)uracil

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) lithium diisopropylamide (LDA) / 1.) THF, -70 deg C, 1 h, 2.) THF, -70 deg C, 1 h

2: 65 percent / 1 N aq. NaOH, 35percent H₂O₂ / 1 h / Ambient temperature

With sodium hydroxide; dihydrogen peroxide; lithium diisopropyl amide;
DOI:10.1021/jm00103a009