AG00AC92

174899-86-6 | 1-(2-HYDROXYETHYL)-3-METHYLIMIDAZOLIUM BIS(TRIFLUOROMETHYLSULFONYL)IMIDE

AG00AC92

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CAS Number	174899-86-6
Catalog Number	AG00AC92(AGN-PC-0QANQN)
Chemical Name	1-(2-HYDROXYETHYL)-3-METHYLIMIDAZOLIUM BIS(TRIFLUOROMETHYLSULFONYL)IMIDE
IUPAC Name	bis(trifluoromethylsulfonyl)azanide;2-(3-methylimidazol-3-ium-1-yl)ethanol
InChI	InChI=1S/C6H11N2O.C2F6NO4S2/c1-7-2-3-8(6-7)4-5-9;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h2-3,6,9H,4-5H2,1H3;/q+1;-1
InChI Key	GIIZYNGNGTZORC-UHFFFAOYSA-N
MDL Number	MFCD09038874
Molecular Formula	C8H11F6N3O5S2
Molecular Weight	407.3105
NSC Number	747122
SMILES	[N-](S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F.OCC[N+]1=CN(C=C1)C
Synonyms	174899-86-6, NSC-747122, 1-(2-Hydroxyethyl)-3-methylimidazolium bis(trifluoromethanesulfonyl)imide, MFCD09038874, 1-(2-Hydroxyethyl)-3-methylimidazolium bis(trifluoromethylsulfonyl)imide, 1-(2 inverted exclamation mark -hydroxylethyl)-3-methylimidazolium bis((trifluoromethyl)sulfonyl)imide, GIIZYNGNGTZORC-UHFFFAOYSA-N, CHEMBL593850, SCHEMBL3678674, 1-Hydroxyethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide, NSC747122, ACM174899866, 1-Ethanol-3-methylimidazolium bis(trifluoromethanesulfonyl)imide, 1-(2'-hydroxylethyl)-3-methylimidazoliumbis((trifluoromethyl)sulfonyl)imide, 1-(2-hydroxyethyl)-3-methylimidazolium bis((trifluoromethyl)sulfonyl)imide, 1-(2-hydroxyethyl)-3-methylimidazolium bis(trifluoromethanesulfonyl)amide, H1670,

Complexity	461
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	407.004g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	407.302g/mol
Monoisotopic Mass	407.004g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	115A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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