6-Mercaptonicotinamide

Base Information

• Chemical Name: 6-Mercaptonicotinamide
• CAS No.: 7151-89-5
• Molecular Formula: C6H6N2OS
• Molecular Weight: 154.1896
• NSC Number: 71913
• UNII: SV73MCW4KF
• DSSTox Substance ID: DTXSID10221744
• Nikkaji Number: J3.084.568D

Synonyms:6-Mercaptonicotinamide;7151-89-5;Nicotinamide, 6-mercapto-;SV73MCW4KF;NSC 71913;NSC-71913;C6H6N2OS;NSC71913;starbld0019179;6-sulfanylidene-1H-pyridine-3-carboxamide;UNII-SV73MCW4KF;SCHEMBL1647540;DTXSID10221744;AKOS017530433;SB21214;2-MERCAPTOPYRIDINE-5-CARBOXAMIDE;6-MERCAPTO-3-PYRIDINECARBOXIMIDE;FT-0752437;3-Pyridinecarboxamide, 1,6-dihydro-6-thioxo-;1,6-DIHYDRO-6-THIOXO-3-PYRIDINECARBOXAMIDE

Chemical Property of 6-Mercaptonicotinamide

Chemical Property:

• Vapor Pressure: 0.000282mmHg at 25°C
• Boiling Point: 322.3°Cat760mmHg
• Flash Point: 148.7°C
• Density: 1.4g/cm³
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 154.02008399
• Heavy Atom Count: 10
• Complexity: 242

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=S)NC=C1C(=O)N

Technology Process of 6-Mercaptonicotinamide

There total 3 articles about 6-Mercaptonicotinamide 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: 3.0%

6-chloro-3-pyridinecarboxamide (6271-78-9) → 6-mercapto-nicotinamide (7151-89-5)

Guidance literature:

6-chloro-3-pyridinecarboxamide; With thiourea; In ethanol; for 48h; Reflux;

With water; sodium hydroxide; In ethanol; Reflux;

Reference yield:

S-(5-carbamyl-2-pyridyl)thiuronium chloride → 6-mercapto-nicotinamide (7151-89-5)

Guidance literature:

With sodium hydroxide; at 20 ℃; for 0.75h;

DOI:10.1002/jps.24060

Reference yield:

→ 6-mercapto-nicotinamide (7151-89-5)

Guidance literature:

With sodium hydroxide;

DOI:10.1039/jr9480001939

upstream raw materials:

6-chloro-3-pyridinecarboxamide

Downstream raw materials:

2-methylthio-5-pyridinecarboxamide

6-(methylsulfonyl)nicotinonitrile

6-methanesulfonyl-nicotinamidine

6-methanesulfonyl-nicotinic acid amide

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