2-(Propylthio)nicotinamide

Base Information

• Chemical Name: 2-(Propylthio)nicotinamide
• CAS No.: 175135-26-9
• Molecular Formula: C9H12 N2 O S
• Molecular Weight: 196.27
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID20379083
• Wikidata: Q82168748
• Mol file: 175135-26-9.mol

Synonyms:2-(propylthio)nicotinamide;175135-26-9;2-(n-Propylthio)nicotinamide;2-propylsulfanylpyridine-3-carboxamide;3-Pyridinecarboxamide, 2-(propylthio)-;Maybridge1_001275;Oprea1_553404;SCHEMBL740927;HMS545B21;DTXSID20379083;2-(propylthio)-3-pyridinecarboxamide;AKOS006227813;3-Pyridinecarboxamide,2-(propylthio)-;FT-0608916;A811727;W-206088

Chemical Property of 2-(Propylthio)nicotinamide

Chemical Property:

• Vapor Pressure: 1.44E-05mmHg at 25°C
• Melting Point: 146-148°C
• Boiling Point: 366.7°Cat760mmHg
• Flash Point: 175.6°C
• PSA: 81.28000
• Density: 1.2g/cm³
• LogP: 2.38290
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 196.06703418
• Heavy Atom Count: 13
• Complexity: 175

Purity/Quality:

99% ^*data from raw suppliers

2-(PROPYLTHIO)NICOTINAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCSC1=C(C=CC=N1)C(=O)N