[4-(3-piperidin-1-ium-1-ylpropoxycarbonyl)-3-propoxyphenyl]azanium dichloride

CAS: 100311-15-7

Molecular Formula	`C18H30Cl2N2O3`
Molecular Weight	393.3 g/mol
Topological Polar Surface Area	67.6 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	392.16336
Heavy Atoms	25
Complexity	345.0

Chemical Identifiers

CAS Number	100311-15-7
SMILES	`CCCOC1=C(C=CC(=C1)[NH3+])C(=O)OCCC[NH+]2CCCCC2.[Cl-].[Cl-]`
InChIKey	`FONMKNLITDGQCR-UHFFFAOYSA-N`

📖 Product Overview

[4-(3-piperidin-1-ium-1-ylpropoxycarbonyl)-3-propoxyphenyl]azanium dichloride (CAS: 100311-15-7) is a chemical compound with molecular formula C18H30Cl2N2O3 and molecular weight 393.3 g/mol. Its IUPAC systematic name is [4-(3-piperidin-1-ium-1-ylpropoxycarbonyl)-3-propoxyphenyl]azanium dichloride. Topological Polar Surface Area 67.6 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 9 Exact Mass 392.16336 Heavy Atoms 25 Complexity 345.0 InChI Key: FONMKNLITDGQCR-UHFFFAOYSA-N. SMILES: CCCOC1=C(C=CC(=C1)[NH3+])C(=O)OCCC[NH+]2CCCCC2.[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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