[3-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]-2-hydroxypropyl]-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride structure

[3-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]-2-hydroxypropyl]-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride

[3-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]-2-hydroxypropyl]-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride

CAS: 66968-01-2
Molecular Formula C33H68Cl2N2O
Molecular Weight 579.8 g/mol
Topological Polar Surface Area 20.2 A2
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 12
Exact Mass 578.4709
Heavy Atoms 38
Complexity 611.0

Chemical Identifiers

CAS Number 66968-01-2
SMILES CC1CCCC(C1CCC(C)[N+](C)(C)CC(C[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)O)(C)C.[Cl-].[Cl-]
InChIKey OHINFQJUFNEOKA-UHFFFAOYSA-L

📖 Product Overview

[3-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]-2-hydroxypropyl]-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride (CAS: 66968-01-2) is a chemical compound with molecular formula C33H68Cl2N2O and molecular weight 579.8 g/mol. Its IUPAC systematic name is [3-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]-2-hydroxypropyl]-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride. Topological Polar Surface Area 20.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 12 Exact Mass 578.4709 Heavy Atoms 38 Complexity 611.0 InChI Key: OHINFQJUFNEOKA-UHFFFAOYSA-L. SMILES: CC1CCCC(C1CCC(C)[N+](C)(C)CC(C[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)O)(C)C.[Cl-].[Cl-].

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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 [3-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]-2-hydroxypropyl]-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride.

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