5-(2-Chloroethyl)-2'-deoxyuridine

Base Information

Chemical Name:5-(2-Chloroethyl)-2'-deoxyuridine
CAS No.:90301-59-0
Molecular Formula:C11H15 Cl N2 O5
Molecular Weight:290.7
Hs Code.:
UNII:H1SZ5QC7QD
DSSTox Substance ID:DTXSID501034152
Nikkaji Number:J413.993C
ChEMBL ID:CHEMBL2079575
Mol file:90301-59-0.mol

Synonyms:2'-deoxy-5-(2-chloroethyl)uridine;5-(2-chloroethyl)-2'-deoxyuridine

Suppliers and Price of 5-(2-Chloroethyl)-2'-deoxyuridine

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 5 raw suppliers

Chemical Property of 5-(2-Chloroethyl)-2'-deoxyuridine

Chemical Property:

Melting Point:161-164 °C
Boiling Point:°Cat760mmHg
PKA:9.24±0.10(Predicted)
Flash Point:°C
PSA：104.55000
Density:1.485g/cm³
LogP:-1.04140
XLogP3:-0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:290.0669493
Heavy Atom Count:19
Complexity:414

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1C(C(OC1N2C=C(C(=O)NC2=O)CCCl)CO)O
Isomeric SMILES:C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)CCCl)CO)O

Technology Process of 5-(2-Chloroethyl)-2'-deoxyuridine

There total 10 articles about 5-(2-Chloroethyl)-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: 90.0%

: 90301-69-2
5-(2-chloroethyl)-1-(2-deoxy-3,5-di-O-p-toluoyl-β-D-erythro-pentofuranosyl)-1H,3H-pyrimidine-2,4-dione

: 90301-59-0
5-(2-chloroethyl)-1-(2-deoxy-β-D-erythro-pentofuranosyl)-1H,3H-pyrimidine-2,4-dione

Guidance literature:: With sodium ethanolate; In ethanol; Ambient temperature;
DOI:10.1021/jm00149a024

Reference yield: 90.0%

: 97975-00-3
5-(2-deoxy-β-D-erythro-pentofuranosyl)-2,3-dihydro-5H-furano<2,3-d>pyrimidin-6-one

: 90301-59-0
5-(2-chloroethyl)-1-(2-deoxy-β-D-erythro-pentofuranosyl)-1H,3H-pyrimidine-2,4-dione

Guidance literature:: With ammonium chloride; In N,N-dimethyl-formamide; at 85 ℃; for 24h;
DOI:10.1002/jlcr.684

Reference yield:

: 3056-12-0,3601-89-6,4330-21-6,52304-86-6,141846-57-3
2-deoxy-3,5-di-O-(p-toluoyl)-α-D-erythropentofuranosyl chloride

: 90301-59-0
5-(2-chloroethyl)-1-(2-deoxy-β-D-erythro-pentofuranosyl)-1H,3H-pyrimidine-2,4-dione

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) trimethylchlorosilane, hexamethyldisilazane, 2.) trimethylsilyl triflate / 1.) reflux, 3 h, 2.) CHCl₃, RT, 1 h

2: 90 percent / 1N NaOEt / ethanol / Ambient temperature

With chloro-trimethyl-silane; trimethylsilyl trifluoromethanesulfonate; sodium ethanolate; 1,1,1,3,3,3-hexamethyl-disilazane; In ethanol;
DOI:10.1021/jm00149a024