Adenosine, 5'-deoxy-5',5'-difluoro-

Base Information

Chemical Name:Adenosine, 5'-deoxy-5',5'-difluoro-
CAS No.:131077-98-0
Molecular Formula:C₁₀H₁₁F₂N₅O₃
Molecular Weight:287.226
Hs Code.:
DSSTox Substance ID:DTXSID40927065
Nikkaji Number:J374.092G
Wikidata:Q82901686
Mol file:131077-98-0.mol

Synonyms:5',5'-difluoro-5'-deoxyadenosine;5'-deoxy-5',5'-difluoroadenosine;5'-deoxy-5'-difluoroadenosine;5-DDFA

Suppliers and Price of Adenosine, 5'-deoxy-5',5'-difluoro-

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 2 raw suppliers

Chemical Property of Adenosine, 5'-deoxy-5',5'-difluoro-

Chemical Property:

Vapor Pressure:7.6E-16mmHg at 25°C
Boiling Point:612.3°Cat760mmHg
Flash Point:324.1°C
PSA：119.31000
Density:2.1g/cm³
LogP:-0.12600
XLogP3:-0.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:2
Exact Mass:287.08299555
Heavy Atom Count:20
Complexity:366

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)C(F)F)O)O)N
Isomeric SMILES:C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)C(F)F)O)O)N

Technology Process of Adenosine, 5'-deoxy-5',5'-difluoro-

There total 9 articles about Adenosine, 5'-deoxy-5',5'-difluoro- 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: 86.0%

: 134868-31-8
5'-deoxy-5',5'-difluoro-2',3'-O-isopropylideneadenosine

: 131077-98-0
5'-deoxy-5',5'-difluoroadenosine

Guidance literature:: With trifluoroacetic acid; In water; at 0 - 25 ℃; for 3h;
DOI:10.1016/j.bioorg.2015.11.003

Reference yield:

: 119244-47-2
N⁶,N⁶-bis-benzoyl-2',3'-O-isopropylideneadenosine-5'-aldehyde

: 131077-98-0
5'-deoxy-5',5'-difluoroadenosine

Guidance literature:: Multi-step reaction with 3 steps

1: 18 percent / (diethylamido)sulfur trifluoride / CH₂Cl₂ / 6 h

2: NH₃ / ethanol / 24 h

3: 68 percent / CF₃COOH / H₂O / 1 h

With (diethylamido)sulfur trifluoride; ammonia; trifluoroacetic acid; In ethanol; dichloromethane; water;
DOI:10.1021/jm00106a028

Reference yield:

: 119244-34-7
N⁶,N⁶-dibenzoyl-5'deoxy-5',5'-difluoro-2',3'-O-isopropylideneadenosine

: 131077-98-0
5'-deoxy-5',5'-difluoroadenosine

Guidance literature:: Multi-step reaction with 2 steps

1: NH₃ / ethanol / 24 h

2: 68 percent / CF₃COOH / H₂O / 1 h

With ammonia; trifluoroacetic acid; In ethanol; water;
DOI:10.1021/jm00106a028