9-(Tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine

Base Information

• Chemical Name: 9-(Tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine
• CAS No.: 7306-67-4
• Molecular Formula: C10H13N5O
• Molecular Weight: 219.246
• Hs Code.: 2934999090
• European Community (EC) Number: 633-327-8
• NSC Number: 38728
• DSSTox Substance ID: DTXSID40274344
• Nikkaji Number: J276.895J
• Mol file: 7306-67-4.mol

Synonyms:9-(tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine;7306-67-4;9-(oxan-2-yl)purin-6-amine;6-Amino-9-(tetrahydropyran-2-yl)-9H-purine;MFCD00213333;NSC38728;Oprea1_146022;9-N-Tetrahydropyranyl-adenine;SCHEMBL675830;DTXSID40274344;6-Amino-9-tetrahydropyranylpurine;AMY20823;NSC-38728;DS-14099;SY029480;6-AMINO-9-TETRAHYDROPYRANAL PURINE;CS-0019297;N12471;9-(Tetrahydro-pyran-2-yl)-9H-purin-6-ylaMine;9-[(Tetrahydro-2H-pyran)-2-yl]-6-amino-9H-purine

Chemical Property of 9-(Tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine

Chemical Property:

• Vapor Pressure: 2.74E-09mmHg at 25°C
• Melting Point: 187-189 °C
• Boiling Point: 477.7°Cat760mmHg
• PKA: 3.86±0.10(Predicted)
• Flash Point: 242.7°C
• PSA: 78.85000
• Density: 1.6g/cm³
• LogP: 1.68880
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 219.11201006
• Heavy Atom Count: 16
• Complexity: 251

Purity/Quality:

97% ^*data from raw suppliers

6-Amino-9-(tetrahydropyran-2-yl)-9H-purine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCOC(C1)N2C=NC3=C(N=CN=C32)N

Technology Process of 9-(Tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine

There total 1 articles about 9-(Tetrahydro-2h-pyran-2-yl)-9h-purin-6-amine 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:

→ 6-Amino-9-(2-tetrahydropyranyl)purine (7306-67-4)

Guidance literature:

6-Chlor-9--purin, methanol. NH3, verschlossenes Rohr;

Reference yield: 51.0%

3-(1-bromoethyl)-8-methyl-2-o-tolylisoquinolin-1(2H)-one (1172117-51-9) + 6-Amino-9-(2-tetrahydropyranyl)purine (7306-67-4) → 8-methyl-3-(1-(9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-ylamino)ethyl)-2-o-tolylisoquinolin-1(2H)-one (1172117-52-0)

Guidance literature:

6-Amino-9-(2-tetrahydropyranyl)purine; With sodium hydride; In N,N-dimethyl-formamide; mineral oil;

3-(1-bromoethyl)-8-methyl-2-o-tolylisoquinolin-1(2H)-one; In N,N-dimethyl-formamide; mineral oil;

Reference yield:

6-Amino-9-(2-tetrahydropyranyl)purine (7306-67-4) → 8-(benzyloxy)-9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-amine

Guidance literature:

Multi-step reaction with 2 steps

1: bromine / methanol; tetrahydrofuran / 3 h / 20 °C / pH 5.2

2: sodium hydride / N,N-dimethyl-formamide / 2.5 h / 55 °C

With bromine; sodium hydride; In tetrahydrofuran; methanol; N,N-dimethyl-formamide;

DOI:10.1021/acs.orglett.5b00329

Downstream raw materials:

8-methyl-3-(1-(9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-ylamino)ethyl)-2-o-tolylisoquinolin-1(2H)-one

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