Ara-ada

Base Information

Chemical Name:Ara-ada
CAS No.:65174-96-1
Molecular Formula:C₁₄H₁₇N₅O₆
Molecular Weight:351.319
Hs Code.:
Nikkaji Number:J2.708.238F
Wikidata:Q107862342
ChEMBL ID:CHEMBL3228686
Mol file:65174-96-1.mol

Synonyms:ARA-ADA;arabinofuranosyladenine-2',3'-diacetate;vidarabine 2',3'-diacetate

Suppliers and Price of Ara-ada

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 Ara-ada

Chemical Property:

Vapor Pressure:3.37E-15mmHg at 25°C
Boiling Point:599°C at 760 mmHg
Flash Point:316.1°C
PSA：151.68000
Density:1.72g/cm³
LogP:-0.25720
XLogP3:-0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:351.11788328
Heavy Atom Count:25
Complexity:522

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)OC1C(OC(C1OC(=O)C)N2C=NC3=C(N=CN=C32)N)CO
Isomeric SMILES:CC(=O)O[C@@H]1[C@H](O[C@H]([C@H]1OC(=O)C)N2C=NC3=C(N=CN=C32)N)CO

Technology Process of Ara-ada

There total 5 articles about Ara-ada 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: 83.0%

: 15830-52-1,953089-09-3
(2R,3R,4S,5R)-2-(acetoxymethyl)-5-(6-amino-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate

: 65174-96-1
9-<2,3-di-O-acetyl-β-D-arabinofuranosyl>adenine

Guidance literature:: With Candida antarctica B lipase; at 30 ℃; for 24h; pH=7; regioselective reaction; aq. phosphate buffer; Enzymatic reaction;
DOI:10.1016/j.molcatb.2009.10.011

Reference yield:

: Acetic acid (2R,3R,4S,5R)-4-acetoxy-5-(6-amino-purin-9-yl)-2-(tert-butyl-diphenyl-silanyloxymethyl)-tetrahydro-furan-3-yl ester

: 65174-96-1
9-<2,3-di-O-acetyl-β-D-arabinofuranosyl>adenine

Guidance literature:: With tetrabutyl ammonium fluoride; acetic acid;
DOI:10.1021/jm960828p

Reference yield:

: 5536-17-4
arabinosyl adenine

: 65174-96-1
9-<2,3-di-O-acetyl-β-D-arabinofuranosyl>adenine

Guidance literature:: Multi-step reaction with 3 steps

1: pyridine / 24 h / Ambient temperature

2: pyridine / 7 h / 3 °C

3: TBAF/CH₃CO₂H

With pyridine; tetrabutyl ammonium fluoride; acetic acid;
DOI:10.1021/jm960828p