5-(2-Amino-6-methoxy-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

Base Information

• Chemical Name: 5-(2-Amino-6-methoxy-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
• CAS No.: 52225-08-8
• Molecular Formula: C₁₁H₁₅N₅O₄
• Molecular Weight: 281.271
• NSC Number: 100044
• DSSTox Substance ID: DTXSID10295167,DTXSID40966994
• ChEMBL ID: CHEMBL1995639
• Mol file: 52225-08-8.mol

Synonyms:NSC100044;52225-08-8;NSC-100044;O6-Methyldeoxy ? guanosine;CHEMBL1995639;SCHEMBL21162582;DTXSID10295167;DTXSID40966994;AKOS040763865;52562-36-4;NCI60_000001;FT-0771488;5-(2-amino-6-methoxy-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol;9-(2-Deoxypentofuranosyl)-6-methoxy-3,9-dihydro-2H-purin-2-imine

Chemical Property of 5-(2-Amino-6-methoxy-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

Chemical Property:

• Vapor Pressure: 3.97E-19mmHg at 25°C
• Boiling Point: 674.7°C at 760 mmHg
• Flash Point: 361.9°C
• Density: 1.84g/cm³
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 281.11240398
• Heavy Atom Count: 20
• Complexity: 349

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)N

Technology Process of 5-(2-Amino-6-methoxy-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

There total 36 articles about 5-(2-Amino-6-methoxy-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol 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: 100.0%

2'-deoxy-N2-isobutyryl-O6-methylguanosine (82921-45-7) → 2-amino-9-(2-deoxy-β-D-erythro-pentofuranosyl)-6-methoxypurine (964-21-6,52225-08-8)

Guidance literature:

With ammonium hydroxide; at 50 ℃; for 72h;

DOI:10.1016/S0040-4039(00)87314-1

Reference yield: 85.0%

2-N-trifluoroacetamido-6-pentafluorophenoxy-9-(2-deoxy-β-D-erythro-pentofuranosyl)purine (128790-76-1) + sodium methylate (124-41-4) → 2-amino-9-(2-deoxy-β-D-erythro-pentofuranosyl)-6-methoxypurine (964-21-6,52225-08-8)

Guidance literature:

In methanol; at 55 ℃; for 36h;

DOI:10.1021/jo00051a051

Reference yield: 76.0%

2-amino-9-[2-deoxy-3,5-di-O-(4-toluoyl)-β-D-erythto-pentofuranosyl]-6-methoxy-9-H-purine → 2-amino-9-(2-deoxy-β-D-erythro-pentofuranosyl)-6-methoxypurine (964-21-6,52225-08-8)

Guidance literature:

With sodium methylate; In methanol; for 1h;

DOI:10.1002/hlca.19960790215

upstream raw materials:

2-N-trifluoroacetamido-6-pentafluorophenoxy-9-(2-deoxy-β-D-erythro-pentofuranosyl)purine

sodium methylate

2'-Deoxyguanosine

trimethylsulphonium hydroxide