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Home > Imidazoles > 1352947-63-7
1352947-63-7 | 1-Methyl-3-[6-(Methylthio)hexyl]iMidazoliuM p-Toluenesulfonate
CAS No: 1352947-63-7 Catalog No: AG009FP9 MDL No:
Product Description
Catalog Number:
AG009FP9
Chemical Name:
1-Methyl-3-[6-(Methylthio)hexyl]iMidazoliuM p-Toluenesulfonate
CAS Number:
1352947-63-7
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
Properties
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
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