RefChem:77113 structure

RefChem:77113

ethyl-dimethyl-[3-(propanoylamino)propyl]azanium;ethyl sulfate

Also Known As: EINECS 268-401-5|1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxopropyl)amino]-, ethyl sulfate|1-Propanaminium, N-ethyl-N,N-dimethyl-3-((1-oxopropyl)amino)-, ethyl sulfate|1-Propanaminium, N-ethyl-N,N-dimethyl-3-((1-oxopropyl)amino)-, ethyl sulfate (1:1)|Ethyldimethyl(3-((1-oxopropyl)amino)propyl)ammonium ethyl sulphate|n-ethyl-n,n-dimethyl-3-(propionylamino)propan-1-aminium ethyl sulfate|ethyl-dimethyl-[3-(propanoylamino)propyl]azanium; ethyl sulfate|N-Ethyl-N,N-dimethyl-3-propanamidopropan-1-aminium ethyl sulfate|ETHYLDIMETHYL[3-[(1-OXOPROPYL)AMINO]PROPYL]AMMONIUM ETHYL SULPHATE|1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxopropyl)amino]-, ethyl sulfate (1:1)

CAS: 68083-52-3
Molecular Formula C12H28N2O5S
Molecular Weight 312.1719 g/mol
LogP 0.48
Topological Polar Surface Area 95.53 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 312.1719
Heavy Atoms 20
Complexity 354.9

Chemical Identifiers

CAS Number 68083-52-3
SMILES CCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]

Product Overview

RefChem:77113 (CAS 68083-52-3), with molecular formula C12H28N2O5S and molecular weight 312.1719 g/mol. IUPAC: ethyl-dimethyl-[3-(propanoylamino)propyl]azanium;ethyl sulfate.

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