N-(6-Aminohexyl)adenosine

Base Information

• Chemical Name: N-(6-Aminohexyl)adenosine
• CAS No.: 56934-06-6
• Molecular Formula: C16H26N6O4
• Molecular Weight: 366.42
• DSSTox Substance ID: DTXSID30709918
• Wikidata: Q82645064
• Mol file: 56934-06-6.mol

Synonyms:56934-06-6;(2R,3R,4S,5R)-2-(6-((6-Aminohexyl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol;N-(6-Aminohexyl)adenosine;n6-(6-aminohexyl)-adenosine;SCHEMBL5675415;DTXSID30709918;(2R,3R,4S,5R)-2-{6-[(6-aminohexyl)amino]-9H-purin-9-yl}-5-(hydroxymethyl)oxolane-3,4-diol

Chemical Property of N-(6-Aminohexyl)adenosine

Chemical Property:

• XLogP3: 0.1
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 366.20155333
• Heavy Atom Count: 26
• Complexity: 434

Purity/Quality:

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)CO)O)O)NCCCCCCN
• Isomeric SMILES: C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NCCCCCCN

Technology Process of N-(6-Aminohexyl)adenosine

There total 3 articles about N-(6-Aminohexyl)adenosine 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: 96.0%

1,6-Hexanediamine (124-09-4) + 6-Chloropurine riboside (2004-06-0) → N6-(6-Aminohexyl)adenosine (56934-06-6)

Guidance literature:

With triethylamine; In ethanol; for 2h; Reflux;

DOI:10.1002/chem.201803234

Reference yield:

1,6-Hexanediamine (124-09-4) + Inosine (58-63-9) → N6-(6-Aminohexyl)adenosine (56934-06-6)

Guidance literature:

With methanol; toluene-4-sulfonic acid; 1,1,1,3,3,3-hexamethyl-disilazane; Multistep reaction; 1.) 145 deg C, 2.) reflux, 2 h;

DOI:10.1080/15257779508012450

Reference yield:

→ N6-(6-Aminohexyl)adenosine (56934-06-6)

Guidance literature:

upstream raw materials:

1,6-Hexanediamine

Inosine

6-Chloropurine riboside