AG003EB0

681856-28-0 | 1-Ethyl-3-methyl-1H-imidazol-3-ium trifluoro(trifluoromethyl)borate

AG003EB0

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CAS Number	681856-28-0
Catalog Number	AG003EB0(AGN-PC-0TRNQB)
Chemical Name	1-Ethyl-3-methyl-1H-imidazol-3-ium trifluoro(trifluoromethyl)borate
IUPAC Name	1-ethyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide
InChI	InChI=1S/C6H11N2.CBF6/c1-3-8-5-4-7(2)6-8;3-1(4,5)2(6,7)8/h4-6H,3H2,1-2H3;/q+1;-1
InChI Key	YTANZWHOSGQGAP-UHFFFAOYSA-N
MDL Number	MFCD15072163
Molecular Formula	C7H11BF6N2
Molecular Weight	247.9771
SMILES	CCn1cc[n+](C)c1.F[B-](F)(F)C(F)(F)F
Synonyms	681856-28-0, 1-Ethyl-3-methylimidazolium Trifluoro(trifluoromethyl)borate, 1-Ethyl-3-methyl-1H-imidazol-3-ium trifluoro(trifluoromethyl)borate, SCHEMBL3601931, CTK8B3608, DTXSID10659841, ANW-42802, MFCD15072163, RTR-037479, KS-0000133W, TR-037479, E0836, 1-ethyl-3-methylimidazolium trifluoromethyltrifluoroborate, 1-Ethyl-3-methylimidazoliumTrifluoro(trifluoromethyl)borate, 1-Ethyl-3-methyl-1H-imidazol-3-ium trifluoro(trifluoromethyl)borate(1-), 1-ethyl-3-methyl-1H-imidazol-3-ium; trifluoro(trifluoromethyl)boranuide,

Complexity	148
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	248.092g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	247.979g/mol
Monoisotopic Mass	248.092g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	8.8A^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-P337+P313-P305+P351+P338-P362+P364-P332+P313
UN Code

Certificate of Analysis

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