sulfoxone

[4-[4-(sulfinomethylamino)phenyl]sulfonylanilino]methanesulfinic acid

CAS: 144-76-3

Molecular Formula	`C14H16N2O6S3`
Molecular Weight	404.5 g/mol
LogP	1.2
Topological Polar Surface Area	180.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	10
Rotatable Bonds	8
Exact Mass	404.01706
Heavy Atoms	25
Complexity	520.0

Chemical Identifiers

CAS Number	144-76-3
SMILES	`C1=CC(=CC=C1NCS(=O)O)S(=O)(=O)C2=CC=C(C=C2)NCS(=O)O`
InChIKey	`NEDPPCHNEOMTJV-UHFFFAOYSA-N`

📖 Product Overview

sulfoxone (CAS: 144-76-3) is a chemical compound with molecular formula C14H16N2O6S3 and molecular weight 404.5 g/mol. Its IUPAC systematic name is [4-[4-(sulfinomethylamino)phenyl]sulfonylanilino]methanesulfinic acid. LogP 1.2 Topological Polar Surface Area 180.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 10 Rotatable Bonds 8 Exact Mass 404.01706 Heavy Atoms 25 Complexity 520.0 InChI Key: NEDPPCHNEOMTJV-UHFFFAOYSA-N. SMILES: C1=CC(=CC=C1NCS(=O)O)S(=O)(=O)C2=CC=C(C=C2)NCS(=O)O.

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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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