Cinnolin-3-amine

Base Information

• Chemical Name: Cinnolin-3-amine
• CAS No.: 17372-79-1
• Molecular Formula: C8H7N3
• Molecular Weight: 145.164
• European Community (EC) Number: 834-269-8
• DSSTox Substance ID: DTXSID90400873
• Nikkaji Number: J1.604.903D
• Wikidata: Q82203933

Synonyms:Cinnolin-3-amine;17372-79-1;3-aminocinnoline;aminocinnoline;3-Cinnolinamine;SCHEMBL2014209;DTXSID90400873;DKJAESIQEOLWNK-UHFFFAOYSA-N;MFCD00956185;AKOS006274004;BS-41997;CS-0060744;EN300-253769;W16974;AC-907/34119049;Z1198155761

Chemical Property of Cinnolin-3-amine

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 145.063997236
• Heavy Atom Count: 11
• Complexity: 137

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(N=N2)N

Technology Process of Cinnolin-3-amine

There total 1 articles about Cinnolin-3-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:

3-bromocinnoline (78593-33-6) → 3-aminocinnoline (17372-79-1)

Guidance literature:

With ammonia; water; copper(II) sulfate;

DOI:10.1039/jr9530001811

Reference yield:

3-aminocinnoline (17372-79-1) → 4-((4-(4,5-dihydro-1H-imidazol-2-yl)phenyl)ethynyl)cinnolin-3-amine

Guidance literature:

Multi-step reaction with 2 steps

1.1: N-iodo-succinimide

2.1: bis-triphenylphosphine-palladium(II) chloride; triphenylphosphine / N,N-dimethyl-formamide / 0.08 h / 45 °C / Inert atmosphere

2.2: 12 h / Inert atmosphere

With bis-triphenylphosphine-palladium(II) chloride; N-iodo-succinimide; triphenylphosphine; In N,N-dimethyl-formamide; 2.1: |Sonogashira Cross-Coupling / 2.2: |Sonogashira Cross-Coupling;

DOI:10.1021/acsmedchemlett.6b00468

upstream raw materials:

3-bromocinnoline

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