1-Ethyl-3-methylimidazolium thiocyanate
Properties
- Molecular formula
- C7H11N3S
- Molar mass
- 169.25 g/mol
- Exact mass
- 169.0674 Da
- logP
- 0.35Crippen estimate
- Polar surface area
- 32.6 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
331717-63-6SMILES
CCN1C=C[N+](=C1)C.C(#N)[S-]InChIKey
VASPYXGQVWPGAB-UHFFFAOYSA-MInChI
InChI=1S/C6H11N2.CHNS/c1-3-8-5-4-7(2)6-8;2-1-3/h4-6H,3H2,1-2H3;3H/q+1;/p-1Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 1-Ethyl-3-methylimidazolium thiocyanate
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.
Thiocyanic acid463-56-9Parent compound
Sodium thiocyanate540-72-7Salt
Ammonium thiocyanate1762-95-4Salt
1-Ethyl-3-methylimidazolium chloride65039-09-0Salt
Copper(I) thiocyanate1111-67-7Salt
Potassium thiocyanate333-20-0Salt
Barium thiocyanate2092-17-3Salt
Cobalt(II) thiocyanate3017-60-5Salt
1-Ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide174899-82-2Salt
Mercury(II) thiocyanate592-85-8Salt
Lead(II) thiocyanate592-87-0Salt
Silver thiocyanate1701-93-5Salt
Similar compounds
1-Methyl-3-propylimidazolium iodide119171-18-544 % similar
1-Propyl-3-methylimidazolium bromide85100-76-144 % similar
1-Butyl-3-methylimidazolium tetrafluoroborate174501-65-642 % similar
1-Butyl-3-methylimidazolium iodide65039-05-641 % similar
1-Butyl-3-methylimidazolium chloride79917-90-141 % similar
1-Butyl-3-methylimidazolium bromide85100-77-241 % similar
1-Butyl-3-methylimidazolium dicyanamide448245-52-141 % similar
1-Hexyl-3-methylimidazolium tetrafluoroborate244193-50-840 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds