1-Ethyl-3-methylimidazolium ethylsulfate

C8H16N2O4SCAS 342573-75-5236.29 g/mol

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Properties

Molecular formula
C8H16N2O4S
Molar mass
236.29 g/mol
Exact mass
236.0831 Da
Density
1.2075 g/mL (at 79.15 °C)
Melting point
−65 °C
logP
-0.18Crippen estimate
Polar surface area
75.2 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
3

Hazards

Not classified as hazardous under GHS by 108 ECHA notifiers. Aggregated from 108 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
342573-75-5
SMILES
CCOS(=O)(=O)[O-].CCn1cc[n+](C)c1
InChIKey
VRFOKYHDLYBVAL-UHFFFAOYSA-M
InChI
InChI=1S/C6H11N2.C2H6O4S/c1-3-8-5-4-7(2)6-8;1-2-6-7(3,4)5/h4-6H,3H2,1-2H3;2H2,1H3,(H,3,4,5)/q+1;/p-1

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

12 names
  • 1H-Imidazolium, 3-ethyl-1-methyl-, ethyl sulfate (1:1)
  • 1H-Imidazolium, 1-ethyl-3-methyl-, ethyl sulfate
  • Ecoeng 212
  • Tego IL-IMES
  • Ecoeng 121
  • E 0650
  • Tego IL EMIM-ES
  • Basionics LQ 01
  • Emin ETOSO3
  • 1-Ethyl-3-methylimidazolium ethylsulfate(1-)
  • LQ 01
  • [EMIM]ETSO4

Work with 1-Ethyl-3-methylimidazolium ethylsulfate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1-Ethyl-3-methylimidazolium chloride65039-09-0Salt 1-Ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide174899-82-2Salt 1-Ethyl-3-methylimidazolium trifluoromethanesulfonate145022-44-2Salt 1-Ethyl-3-methylimidazolium dicyanamide370865-89-7Salt 1-Methylimidazole ethiodide35935-34-3Salt 1-Ethyl-3-methylimidazolium acetate143314-17-4Salt 1-Ethyl-3-methylimidazolium bromide65039-08-9Salt 1-Ethyl-3-methylimidazolium tetrafluoroborate143314-16-3Salt Phenazine ethosulfate10510-77-7Salt 1-Ethyl-3-methylimidazolium diethylphosphate848641-69-0Salt 1-Ethyl-3-methylimidazolium hexafluorophosphate155371-19-0Salt 1-Ethyl-3-methylimidazolium nitrate143314-14-1Salt

Similar compounds

1-Butyl-3-methylimidazolium methanesulfonate342789-81-544 % similar 1-Butyl-3-methylimidazolium trifluoromethanesulfonate174899-66-241 % similar 1-Hexyl-3-methylimidazolium trifluoromethanesulfonate460345-16-839 % similar 1-Methyl-3-propylimidazolium iodide119171-18-538 % similar 1-Propyl-3-methylimidazolium bromide85100-76-138 % similar 1-Butyl-3-methylimidazolium nitrate179075-88-837 % similar 1-Butyl-3-methylimidazolium tetrafluoroborate174501-65-637 % similar 1-Butyl-3-methylimidazolium iodide65039-05-636 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Butyl-3-methylimidazolium hydrogen sulfate262297-13-2

Elsewhere

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