3,5-dibromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxybenzamidemethanesulfonate

3,5-dibromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxybenzamide;methanesulfonate

CAS: 98526-94-4

Molecular Formula	`C16H24Br2N2O6S`
Molecular Weight	532.2 g/mol
Topological Polar Surface Area	129.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	531.97015
Heavy Atoms	27
Complexity	465.0

Chemical Identifiers

CAS Number	98526-94-4
SMILES	`CC[NH+]1CCCC1CNC(=O)C2=C(C(=CC(=C2OC)Br)Br)O.CS(=O)(=O)[O-]`
InChIKey	`DWAVWJJNKXRXSF-FVGYRXGTSA-N`

📖 Product Overview

3,5-dibromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxybenzamidemethanesulfonate (CAS: 98526-94-4) is a chemical compound with molecular formula C16H24Br2N2O6S and molecular weight 532.2 g/mol. Its IUPAC systematic name is 3,5-dibromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxybenzamide;methanesulfonate. Topological Polar Surface Area 129.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 531.97015 Heavy Atoms 27 Complexity 465.0 InChI Key: DWAVWJJNKXRXSF-FVGYRXGTSA-N. SMILES: CC[NH+]1CCCC1CNC(=O)C2=C(C(=CC(=C2OC)Br)Br)O.CS(=O)(=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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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 3,5-dibromo-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-2-hydroxy-6-methoxybenzamidemethanesulfonate.

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