1-((2-Hydroxyethoxy)methyl)-2-thiothymine

Base Information Edit

Chemical Name:1-((2-Hydroxyethoxy)methyl)-2-thiothymine
CAS No.:132885-30-4
Molecular Formula:C₈H₁₂N₂O₃S
Molecular Weight:216.261
Hs Code.:
DSSTox Substance ID:DTXSID70157833
Nikkaji Number:J448.803B
ChEMBL ID:CHEMBL320766
Mol file:132885-30-4.mol

Synonyms:132885-30-4;1-((2-Hydroxyethoxy)methyl)-2-thiothymine;1-((2-OHEtO)Me)-2-ST;1-[(2-Hydroxyethoxy)methyl]-2-thiothymine;1-[(2-OHEtO)Me]-2-ST;CHEMBL320766;DTXSID70157833;1-(2-hydroxyethoxymethyl)-5-methyl-2-thioxo-pyrimidin-4-one;1,2-Dihydro-1-(2-hydroxyethoxymethyl)-5-methyl-2-thioxopyrimidin-4(3H)-one

Suppliers and Price of 1-((2-Hydroxyethoxy)methyl)-2-thiothymine

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
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price

Total 1 raw suppliers

Chemical Property of 1-((2-Hydroxyethoxy)methyl)-2-thiothymine Edit

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:1.38g/cm³
XLogP3:-0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:216.05686342
Heavy Atom Count:14
Complexity:278

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CN(C(=S)NC1=O)COCCO

Technology Process of 1-((2-Hydroxyethoxy)methyl)-2-thiothymine

There total 2 articles about 1-((2-Hydroxyethoxy)methyl)-2-thiothymine 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%

: 116457-80-8
1-<(2-acetoxyethoxy)methyl>-2-thiothymine

: 132885-30-4
1-<(2-hydroxyethoxy)methyl>-2-thiothymine

Guidance literature:: With sodium hydroxide; In ethanol; for 0.166667h; Ambient temperature;
DOI:10.1021/jm00108a023

Reference yield:

: 646-06-0
1,3-DIOXOLANE

: 32865-96-6
bis(trimethylsilyl)-2-thiothymine

: 132885-30-4
1-<(2-hydroxyethoxy)methyl>-2-thiothymine

Guidance literature:: With chloro-trimethyl-silane; potassium iodide; In acetonitrile; for 16h; Yield given; Ambient temperature;
DOI:10.1248/cpb.43.142

Reference yield:

: 132885-30-4
1-<(2-hydroxyethoxy)methyl>-2-thiothymine

: 136632-01-4
1-<<2-<(tert-butyldimethylsilyl)oxy>ethoxy>methyl>-6-(phenylselenenyl)-2-thiothymine

Guidance literature:: Multi-step reaction with 2 steps

1: 86 percent / imidazole / dimethylformamide / Ambient temperature

2: 1.) LDA / 1.) THF, from -78 deg C to -70 deg C, 1 h, 2.) THF, -78 deg C, 30 min

With 1H-imidazole; lithium diisopropyl amide; In N,N-dimethyl-formamide;
DOI:10.1021/jm00115a022