5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

Base Information

Chemical Name:5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine
CAS No.:123881-95-8
Molecular Formula:C₁₂H₁₆FIN₂O₆
Molecular Weight:430.172
Hs Code.:
ChEMBL ID:CHEMBL3143528
DSSTox Substance ID:DTXSID70924623
Nikkaji Number:J273.492C
Mol file:123881-95-8.mol

Synonyms:5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine;123881-95-8;Uridine, 2'-deoxy-2'-fluoro-5-(2-iodo-1-methoxyethyl)-;CHEMBL3143528;DTXSID70924623;1-(2-Deoxy-2-fluoropentofuranosyl)-4-hydroxy-5-(2-iodo-1-methoxyethyl)pyrimidin-2(1H)-one;1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-(2-iodo-1-methoxy-ethyl)pyrimidine-2,4-dione

Suppliers and Price of 5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
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Total 0 raw suppliers

Chemical Property of 5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

Chemical Property:

XLogP3:-0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:430.00371
Heavy Atom Count:22
Complexity:490

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(CI)C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)F
Isomeric SMILES:COC(CI)C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)F

Technology Process of 5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

There total 3 articles about 5-(1-Methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine 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: 91.0%

: 67-56-1
methanol

: 123881-89-0,123881-90-3
5-(1-hydroxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

: 123881-95-8,123881-96-9
5-(1-methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

Guidance literature:: With sulfuric acid; at 25 ℃; for 36h;
DOI:10.1021/jm00164a039

Reference yield:

: 123881-86-7
5-vinyl-2'-fluoro-2'-deoxyuridine

: 123881-95-8,123881-96-9
5-(1-methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

Guidance literature:: Multi-step reaction with 2 steps

1: 72 percent / I₂, KIO₃, 5 N H₂SO₄ / H₂O; acetonitrile / 2 h / 55 °C

2: 91 percent / 5 N H₂SO₄ / 36 h / 25 °C

With potassium iodate; sulfuric acid; iodine; In water; acetonitrile;
DOI:10.1021/jm00164a039

Reference yield:

: 121563-64-2
(E)-3-[1-((2R,3R,4R,5R)-3-Fluoro-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-yl]-acrylic acid

: 123881-95-8,123881-96-9
5-(1-methoxy-2-iodoethyl)-2'-fluoro-2'-deoxyuridine

Guidance literature:: Multi-step reaction with 3 steps

1: 19 percent / triethylamine / dimethylformamide / 6 h / 100 °C

2: 72 percent / I₂, KIO₃, 5 N H₂SO₄ / H₂O; acetonitrile / 2 h / 55 °C

3: 91 percent / 5 N H₂SO₄ / 36 h / 25 °C

With potassium iodate; sulfuric acid; iodine; triethylamine; In water; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1021/jm00164a039