bis(2-hydroxy-2-oxoacetate)[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium

bis(2-hydroxy-2-oxoacetate);[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium

CAS: 10537-03-8

Molecular Formula	`C29H40N2O9`
Molecular Weight	560.6 g/mol
Topological Polar Surface Area	185.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	9
Rotatable Bonds	9
Exact Mass	560.2734
Heavy Atoms	40
Complexity	514.0

Chemical Identifiers

CAS Number	10537-03-8
SMILES	`C1CC[NH+](CC1)CC[NH2+]CC(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O`
InChIKey	`LCLOTVRQFKKGCI-UHFFFAOYSA-N`

📖 Product Overview

bis(2-hydroxy-2-oxoacetate)[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium (CAS: 10537-03-8) is a chemical compound with molecular formula C29H40N2O9 and molecular weight 560.6 g/mol. Its IUPAC systematic name is bis(2-hydroxy-2-oxoacetate);[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium. Topological Polar Surface Area 185.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 9 Rotatable Bonds 9 Exact Mass 560.2734 Heavy Atoms 40 Complexity 514.0 InChI Key: LCLOTVRQFKKGCI-UHFFFAOYSA-N. SMILES: C1CC[NH+](CC1)CC[NH2+]CC(CC2CCCO2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O.C(=O)(C(=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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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for bis(2-hydroxy-2-oxoacetate)[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium.

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