2-[(4-Nitrophenyl)methylsulfanyl]pyridine-3-carboxylic acid structure

2-[(4-Nitrophenyl)methylsulfanyl]pyridine-3-carboxylic acid

2-[(4-nitrophenyl)methylsulfanyl]pyridine-3-carboxylic acid

Also Known As: CBMicro_026399|ChemDiv1_002031|Oprea1_566656|HMS592M07|2-((4-nitrobenzyl)thio)nicotinic acid|2-[(4-nitrobenzyl)thio]nicotinic acid|2-[(4-nitrophenyl)methylsulfanyl]pyridine-3-carboxylic acid|BIM-0026458.P001|2-[(4-nitrobenzyl)sulfanyl]pyridine-3-carboxylic acid|2-{[(4-NITROPHENYL)METHYL]SULFANYL}PYRIDINE-3-CARBOXYLIC ACID|2-[(4-nitrophenyl)methylthio]pyridine-3-carboxylic acid

CAS: 304475-38-5
Molecular Formula C13H10N2O4S
Molecular Weight 290.03613 g/mol
LogP 2.5
Topological Polar Surface Area 121.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 290.03613
Monoisotopic Mass 290.03613
Heavy Atoms 20
Complexity 353.0

Chemical Identifiers

CAS Number 304475-38-5
SMILES C1=CC(=C(N=C1)SCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O
InChIKey LFALEDFUNKOOBJ-UHFFFAOYSA-N

Product Overview

2-[(4-Nitrophenyl)methylsulfanyl]pyridine-3-carboxylic acid (CAS 304475-38-5), with molecular formula C13H10N2O4S and molecular weight 290.03613 g/mol. IUPAC: 2-[(4-nitrophenyl)methylsulfanyl]pyridine-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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