4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-methanol

Base Information

• Chemical Name: 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-methanol
• CAS No.: 49558-38-5
• Molecular Formula: C12H16N4O5
• Molecular Weight: 296.28
• Nikkaji Number: J152.409G
• Mol file: 49558-38-5.mol

Synonyms:NSC 301731;4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-methanol;7H-Pyrrolo(2,3-d)pyrimidine-5-methanol, 4-amino-7-beta-D-ribofuranosyl-

Chemical Property of 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-methanol

Chemical Property:

• Vapor Pressure: 4.06E-22mmHg at 25°C
• Boiling Point: 725.9°C at 760 mmHg
• Flash Point: 392.8°C
• PSA: 146.88000
• Density: 1.93g/cm³
• LogP: -1.30150
• XLogP3: -2.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 296.11206962
• Heavy Atom Count: 21
• Complexity: 376

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C2=C(N=CN=C2N1C3C(C(C(O3)CO)O)O)N)CO
• Isomeric SMILES: C1=C(C2=C(N=CN=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N)CO

Technology Process of 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-methanol

There total 2 articles about 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-methanol 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: 45.0%

5-(Methoxycarbonyl)tubercidin (18440-68-1) → 5-(Hydroxymethyl)tubercidin (49558-38-5)

Guidance literature:

With lithium borohydride; In tetrahydrofuran; for 20h; Heating;

DOI:10.1021/jo00320a038

Reference yield:

→ 1-(4-amino-5-hydroxymethyl-pyrrolo[2,3-d]pyrimidin-7-yl)-β-D-1-deoxy-ribofuranose (49558-38-5)

Guidance literature:

Verb. (4), LiAlH4;

DOI:10.1021/jm00270a021

upstream raw materials:

5-(Methoxycarbonyl)tubercidin

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