2-(Pentylthio)nicotinic acid structure

2-(Pentylthio)nicotinic acid

2-pentylsulfanylpyridine-3-carboxylic acid

Also Known As: 2-(pentylthio)nicotinic acid|ML099 Analog|Maybridge1_001273|2-pentylsulfanylpyridine-3-carboxylic acid|2-(Pentylthio)nicotinicacid|HMS545B19|2-(n-Amylthio)nicotinic acid|2-(pentylsulfanyl)pyridine-3-carboxylic acid|2-(N-PENTYLTHIO)NICOTINIC ACID|Fr13398|3-Pyridinecarboxylicacid, 2-(pentylthio)-|3-Pyridinecarboxylic acid, 2-(pentylthio)-|2-pentylthiopyridine-3-carboxylic acid|AS-9206|I02-7122

CAS: 175135-23-6
Molecular Formula C11H15NO2S
Molecular Weight 225.08235 g/mol
LogP 3.0621
Topological Polar Surface Area 50.19 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 6
Exact Mass 225.08235
Monoisotopic Mass 225.08235
Heavy Atoms 15
Complexity 328.1189

Chemical Identifiers

CAS Number 175135-23-6
SMILES CCCCCSC1=C(C=CC=N1)C(=O)O

Product Overview

2-(Pentylthio)nicotinic acid (CAS 175135-23-6), with molecular formula C11H15NO2S and molecular weight 225.08235 g/mol. IUPAC: 2-pentylsulfanylpyridine-3-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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