1-Ethyl-3-methylimidazolium chloride

C6H11ClN2CAS 65039-09-0146.62 g/mol

Open in Covalent MOL file
NN+Cl−

Properties

Molecular formula
C6H11ClN2
Molar mass
146.62 g/mol
Exact mass
146.0611 Da
Density
1.44 g/mL
Melting point
87 °C
logP
-2.66Crippen estimate
Polar surface area
8.8 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 155 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number
65039-09-0
SMILES
CCn1cc[n+](C)c1.[Cl-]
InChIKey
BMQZYMYBQZGEEY-UHFFFAOYSA-M
InChI
InChI=1S/C6H11N2.ClH/c1-3-8-5-4-7(2)6-8;/h4-6H,3H2,1-2H3;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

13 names · show all
  • 1H-Imidazolium, 3-ethyl-1-methyl-, chloride (1:1)
  • 1H-Imidazolium, 1-ethyl-3-methyl-, chloride
  • 1-Methyl-3-ethylimidazolium chloride
  • 3-Ethyl-1-methylimidazolium chloride
  • 1-Methyl-3-ethylimidazolinium chloride
  • 1-Ethyl-3-methyl-1H-imidazolium chloride
  • N-Methyl-N′-ethylimidazolium chloride
  • EMZ-C 1
  • EMIMCl
  • Basionics ST 80
  • [C2Mim+][cl-]
  • IoLiLyt 0093
  • 1-Ethyl-3-methyl-1H-imidazol-3-ium chloride

Work with 1-Ethyl-3-methylimidazolium chloride

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 bis(trifluoromethylsulfonyl)imide174899-82-2Salt 1-Ethyl-3-methylimidazolium trifluoromethanesulfonate145022-44-2Salt 1-Ethyl-3-methylimidazolium ethylsulfate342573-75-5Salt 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 1-Ethyl-3-methylimidazolium diethylphosphate848641-69-0Salt 1-Ethyl-3-methylimidazolium hexafluorophosphate155371-19-0Salt 1-Ethyl-3-methylimidazolium nitrate143314-14-1Salt 1-Ethyl-3-methylimidazolium P-toluenesulfonate328090-25-1Salt

Similar compounds

1-Butyl-3-methylimidazolium chloride79917-90-163 % similar 1-(2-Hydroxyethyl)-3-methylimidazolium chloride61755-34-859 % similar 1-Dodecyl-3-methyl-1H-imidazol-3-ium Chloride114569-84-559 % similar 1-Hexyl-3-methylimidazolium chloride171058-17-659 % similar 1-Decyl-3-methylimidazolium chloride171058-18-759 % similar 1-Octyl-3-methylimidazolium chloride64697-40-159 % similar 1-Allyl-3-methylimidazolium chloride65039-10-358 % similar 1-Benzyl-3-methylimidazolium chloride36443-80-854 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Piperidinecarbonitrile hydrochloride240401-22-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia