3' (3-(2-Chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine

Base Information

Chemical Name:3' (3-(2-Chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine
CAS No.:96699-73-9
Molecular Formula:C₁₂H₁₆ClN₅O₆
Molecular Weight:361.742
Hs Code.:
DSSTox Substance ID:DTXSID10242393
Wikidata:Q83126077
Mol file:96699-73-9.mol

Synonyms:3' (3-(2-chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine;3'-CDUNU

Suppliers and Price of 3' (3-(2-Chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 3' (3-(2-Chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：149.84000
Density:1.74g/cm³
LogP:-0.26650
XLogP3:-0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:361.0789109
Heavy Atom Count:24
Complexity:558

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3' (3-(2-Chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine

There total 3 articles about 3' (3-(2-Chloroethyl)-3-nitrosoureido)-2',3'-dideoxyuridine 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: 77.0%

: 96699-72-8
3'-<3-(2-chloroethyl)ureido>-2',3'-dideoxyuridine

: 96699-73-9
3'-<3-(2-chloroethyl)-3-nitrosoureido>-2',3'-dideoxyuridine

Guidance literature:: With acetic acid; sodium nitrite; at 0 ℃; for 4h;
DOI:10.1021/jm00155a044

Reference yield:

: 84472-85-5
Navuridine

: 96699-73-9
3'-<3-(2-chloroethyl)-3-nitrosoureido>-2',3'-dideoxyuridine

Guidance literature:: Multi-step reaction with 3 steps

1: H₂ / 10percent Pd/C / ethanol

2: 44 percent / methanol

3: 77 percent / sodium nitrite, 80percent aq. HOAc / 4 h / 0 °C

With hydrogen; acetic acid; sodium nitrite; palladium on activated charcoal; In methanol; ethanol;
DOI:10.1021/jm00155a044

Reference yield:

: 84472-86-6
3'-amino-2',3'-dideoxyuridine

: 96699-73-9
3'-<3-(2-chloroethyl)-3-nitrosoureido>-2',3'-dideoxyuridine

Guidance literature:: Multi-step reaction with 2 steps

1: 44 percent / methanol

2: 77 percent / sodium nitrite, 80percent aq. HOAc / 4 h / 0 °C

With acetic acid; sodium nitrite; In methanol;
DOI:10.1021/jm00155a044