7H-purine-6-carboxamide

Base Information

• Chemical Name: 7H-purine-6-carboxamide
• CAS No.: 37527-29-0
• Molecular Formula: C6H5N5O
• Molecular Weight: 0
• Hs Code.: 2933990090
• NSC Number: 54481
• DSSTox Substance ID: DTXSID60421959
• Nikkaji Number: J277.586G
• Wikidata: Q27132372
• Metabolomics Workbench ID: 62593
• Mol file: 37527-29-0.mol

Synonyms:7H-purine-6-carboxamide;purine-6-caboxamide;37527-29-0;Purin-6-carbonsaeureamid;6-carboxamidopurine;Purin-6-carboxamid;purine-6-carboxamide;9H-purine-6-carboxamide;CHEBI:63088;NSC 54481;1H-PURINE-6-CARBOXAMIDE;6-aminocarbonyl purine;9H-purin-6-carboxamid;Epitope ID:167470;SCHEMBL1749123;DTXSID60421959;NSC54481;NSC-54481;AKOS015904843;Q27132372

Chemical Property of 7H-purine-6-carboxamide

Chemical Property:

• Vapor Pressure: 5.33E-05mmHg at 25°C
• Boiling Point: 347.6°Cat760mmHg
• Flash Point: 164°C
• PSA: 97.55000
• Density: 1.91g/cm³
• LogP: 0.15210
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 163.04940980
• Heavy Atom Count: 12
• Complexity: 196

Purity/Quality:

99% ^*data from raw suppliers

9H-Purine-6-carboxamide 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC2=NC=NC(=C2N1)C(=O)N

Technology Process of 7H-purine-6-carboxamide

There total 5 articles about 7H-purine-6-carboxamide 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:

7(9)H-purine-6-carboxylic acid hydrazide (98198-25-5) → 6-Carbamidopurin (37527-29-0)

Guidance literature:

With potassium hexacyanoferrate(III);

DOI:10.1021/ja01548a033

Reference yield:

7H-purine-6-carbonitrile (2036-13-7) → 6-Carbamidopurin (37527-29-0)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/ja01595a066

Reference yield:

6-iodo-7H-purine (2545-26-8) → 6-Carbamidopurin (37527-29-0)

Guidance literature:

Multi-step reaction with 2 steps

1: pyridine

2: aq. NaOH solution

With pyridine; sodium hydroxide;

DOI:10.1021/ja01595a066

upstream raw materials:

7⁽⁹⁾H-purine-6-carboxylic acid hydrazide

7H-purine-6-carbonitrile

6-iodo-7H-purine

Downstream raw materials:

9-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)purine-6-carboxamide

9-β-D-ribofuranosylpurine-6-carboxamide