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Home > Imidazoles > 82257-34-9
82257-34-9 | 1,1'-CARBONYLBIS(3-IMIDAZOLIUM) BIS(METHANESULFONATE)
CAS No: 82257-34-9 Catalog No: AG005GPQ MDL No:
Product Description
Catalog Number:
AG005GPQ
Chemical Name:
1,1'-CARBONYLBIS(3-IMIDAZOLIUM) BIS(METHANESULFONATE)
CAS Number:
82257-34-9
Molecular Formula:
C9H14N4O7S2
Molecular Weight:
354.3601
IUPAC Name:
di(imidazol-3-ium-1-yl)methanone;methanesulfonate
InChI:
InChI=1S/C7H6N4O.2CH4O3S/c12-7(10-3-1-8-5-10)11-4-2-9-6-11;2*1-5(2,3)4/h1-6H;2*1H3,(H,2,3,4)
InChI Key:
UBUPJKWYSOKZDM-UHFFFAOYSA-N
SMILES:
[O-]S(=O)(=O)C.[O-]S(=O)(=O)C.O=C(n1c[nH+]cc1)n1c[nH+]cc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.03g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
354.352g/mol
Monoisotopic Mass:
354.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
186A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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