1-Butyl-3-(2-pyridinylmethyl)-1H-imidazolium hexafluorophosphate

Catalog Number	ACM873788091-2
CAS	873788-09-1
Structure
Synonyms	2-[(3-Butylimidazol-1-ium-1-yl)methyl]pyridine;hexafluorophosphate
IUPAC Name	2-[(3-butylimidazol-1-ium-1-yl)methyl]pyridine;hexafluorophosphate
Molecular Weight	361.27
Molecular Formula	C13H18F6N3P
Canonical SMILES	CCCC[NH+]1CN(C=C1)CC2=CC=CC=N2.F[P-](F)(F)(F)(F)F;
InChI	LYRTZSJBJXWSOP-UHFFFAOYSA-N
InChI Key	InChI=1S/C13H18N3.F6P/c1-2-3-8-15-9-10-16(12-15)11-13-6-4-5-7-14-13;1-7(2,3,4,5)6/h4-7,9-10,12H,2-3,8,11H2,1H3;/q+1;-1
Purity	98%
Appearance	Liquid
Storage	2-8°C
Complexity	290
Covalently-Bonded Unit Count	2
Exact Mass	363.13g/mol
Heavy Atom Count	23
Isomeric SMILES	CCCCN1C=C[N+](=C1)CC2=CC=CC=N2.F[P-](F)(F)(F)(F)F
Monoisotopic Mass	363.13g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	20.6A^2