N(4)-Hydroxy-5-fluorodeoxycytidine monophosphate

Base Information

Chemical Name:N(4)-Hydroxy-5-fluorodeoxycytidine monophosphate
CAS No.:114333-22-1
Molecular Formula:C₉H₁₃FN₃O₈P
Molecular Weight:341.19
Hs Code.:
DSSTox Substance ID:DTXSID00921327
Nikkaji Number:J1.474.612I
Wikidata:Q82894135
ChEMBL ID:CHEMBL1161226
Mol file:114333-22-1.mol

Synonyms:N(4)-hydroxy-5-fluoro-dCMP;N(4)-hydroxy-5-fluorodeoxycytidine monophosphate;N(4)-OH-5-FdCMP

Suppliers and Price of N(4)-Hydroxy-5-fluorodeoxycytidine monophosphate

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 3 raw suppliers

Chemical Property of N(4)-Hydroxy-5-fluorodeoxycytidine monophosphate

Chemical Property:

Vapor Pressure:1.8E-18mmHg at 25°C
Boiling Point:629.2°Cat760mmHg
Flash Point:334.3°C
PSA：0.00000
Density:2.12g/cm³
LogP:0.00000
XLogP3:-3.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:341.04242954
Heavy Atom Count:22
Complexity:563

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1C(C(OC1N2C=C(C(=NC2=O)NO)F)COP(=O)(O)O)O
Isomeric SMILES:C1[C@@H]([C@H](O[C@H]1N2C=C(C(=NC2=O)NO)F)COP(=O)(O)O)O

Technology Process of N(4)-Hydroxy-5-fluorodeoxycytidine monophosphate

There total 4 articles about N(4)-Hydroxy-5-fluorodeoxycytidine monophosphate 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: 62.0%

: 13491-49-1
1-(β-D-2-deoxyribofuranosyl)-4-hydroxyamino-5-fluoropyrimidin-2(1H)-one

: 114333-22-1
5-fluoro-N⁴-hydroxy-2'-deoxycytidine 5'-monophosphate

Guidance literature:: With tris(p-nitrophenyl)phosphate; wheat shoot nucleoside phosphotransferase; In acetate buffer; at 37 ℃; for 40h; pH=4.0;
DOI:10.1021/jm000975u

Reference yield:

: 161179-94-8
5-fluoro-4-(1,2,4-triazol-1-yl)-1-(3,5-di-O-acetyl-2-deoxy-β-D-ribofuranosyl)-pyrimidine-2(1H)-one

: 114333-22-1
5-fluoro-N⁴-hydroxy-2'-deoxycytidine 5'-monophosphate

Guidance literature:: Multi-step reaction with 3 steps

1: 92 percent / HONH₂*HCl; NaOMe / methanol / 1 h / 20 °C

2: 88 percent / NH₃ / methanol / 12 h / 20 °C

3: 62 percent / p-nitrophenyl phosphate; wheat shoot nucleoside phosphotransferase / acetate buffer / 40 h / 37 °C / pH 4.0

With tris(p-nitrophenyl)phosphate; wheat shoot nucleoside phosphotransferase; hydroxylamine hydrochloride; ammonia; sodium methylate; In methanol; acetate buffer;
DOI:10.1021/jm000975u

Reference yield:

: 214839-08-4
1-(3,5-di-O-acetyl-β-D-2-deoxyribofuranosyl)-4-hydroxyamino-5-fluoropyrimidin-2(1H)-one

: 114333-22-1
5-fluoro-N⁴-hydroxy-2'-deoxycytidine 5'-monophosphate

Guidance literature:: Multi-step reaction with 2 steps

1: 88 percent / NH₃ / methanol / 12 h / 20 °C

2: 62 percent / p-nitrophenyl phosphate; wheat shoot nucleoside phosphotransferase / acetate buffer / 40 h / 37 °C / pH 4.0

With tris(p-nitrophenyl)phosphate; wheat shoot nucleoside phosphotransferase; ammonia; In methanol; acetate buffer;
DOI:10.1021/jm000975u