AG009FP9

Name: 1-Methyl-3-[6-(methylthio)hexyl]imidazolium p-Toluenesulfonate
Brand: Angene Chemical
SKU: AG009FP9

1352947-63-7 | 1-Methyl-3-[6-(methylthio)hexyl]imidazolium p-Toluenesulfonate

AG009FP9

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CAS Number	1352947-63-7
Catalog Number	AG009FP9(AGN-PC-0WNHB1)
Chemical Name	1-Methyl-3-[6-(methylthio)hexyl]imidazolium p-Toluenesulfonate
IUPAC Name	4-methylbenzenesulfonate;1-methyl-3-(6-methylsulfanylhexyl)imidazol-1-ium
InChI	InChI=1S/C11H21N2S.C7H8O3S/c1-12-8-9-13(11-12)7-5-3-4-6-10-14-2;1-6-2-4-7(5-3-6)11(8,9)10/h8-9,11H,3-7,10H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChI Key	OVUBPNDERNKKQU-UHFFFAOYSA-M
MDL Number	MFCD23380210
Molecular Formula	C18H28N2O3S2
Molecular Weight	384.5565
SMILES	C[N+]1=CN(CCCCCCSC)C=C1.CC1=CC=C(C=C1)S(=O)(=O)[O-]
Synonyms	1352947-63-7, 1-Methyl-3-[6-(methylthio)hexyl]imidazolium p-Toluenesulfonate, SCHEMBL16968738, DTXSID50735193, MFCD23380210, M2321, 3-Methyl-1-[6-(methylsulfanyl)hexyl]-1H-imidazol-3-ium 4-methylbenzene-1-sulfonate, OVUBPNDERNKKQU-UHFFFAOYSA-M,

Complexity	334
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	384.154g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	384.553g/mol
Monoisotopic Mass	384.154g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	99.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited