DTXSID00959125 structure

DTXSID00959125

diethyl-[(1S,2S)-2-[(3-hexoxyphenyl)carbamoyloxy]cyclohexyl]azanium chloride

CAS: 38198-32-2
Molecular Formula C23H39ClN2O3
Molecular Weight 427.0 g/mol
Topological Polar Surface Area 52.0 A2
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 12
Exact Mass 426.26492
Heavy Atoms 29
Complexity 428.0

Chemical Identifiers

CAS Number 38198-32-2
SMILES CCCCCCOC1=CC=CC(=C1)NC(=O)OC2CCCCC2[NH+](CC)CC.[Cl-]
InChIKey FZVASDVKRPBOHR-VROPFNGYSA-N

📖 Product Overview

DTXSID00959125 (CAS: 38198-32-2) is a chemical compound with molecular formula C23H39ClN2O3 and molecular weight 427.0 g/mol. Its IUPAC systematic name is diethyl-[(1S,2S)-2-[(3-hexoxyphenyl)carbamoyloxy]cyclohexyl]azanium chloride. Topological Polar Surface Area 52.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 12 Exact Mass 426.26492 Heavy Atoms 29 Complexity 428.0 InChI Key: FZVASDVKRPBOHR-VROPFNGYSA-N. SMILES: CCCCCCOC1=CC=CC(=C1)NC(=O)OC2CCCCC2[NH+](CC)CC.[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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