2-(Methylthio)nicotinamide

Base Information

• Chemical Name: 2-(Methylthio)nicotinamide
• CAS No.: 175135-28-1
• Molecular Formula: C7H8 N2 O S
• Molecular Weight: 168.22
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID10379092
• Wikidata: Q82168756
• Mol file: 175135-28-1.mol

Synonyms:2-(methylthio)nicotinamide;175135-28-1;2-methylsulfanylpyridine-3-carboxamide;2-(methylsulfanyl)pyridine-3-carboxamide;Maybridge1_001564;Oprea1_640184;SCHEMBL1327237;HMS545P02;DTXSID10379092;MFCD00052655;AKOS009077361;AS-9207;SB53864;CS-0324182;FT-0608864;W-206090

Chemical Property of 2-(Methylthio)nicotinamide

Chemical Property:

• Vapor Pressure: 4.72E-05mmHg at 25°C
• Melting Point: 168-170°C
• Boiling Point: 349.4°Cat760mmHg
• Flash Point: 165.1°C
• PSA: 81.28000
• Density: 1.29g/cm³
• LogP: 1.60270
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 168.03573406
• Heavy Atom Count: 11
• Complexity: 151

Purity/Quality:

98%min ^*data from raw suppliers

2-(Methylthio)nicotinamide ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=C(C=CC=N1)C(=O)N